| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 1 |
108-05-4 |
vinyl acetate
|
C4H6O2
|
86.09 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 2 |
109-65-9 |
1-bromobutane
|
C4H9Br
|
137.03 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
|
GIF
PDB
|
| 3 |
78-92-2 |
2-butanol
|
C4H10O
|
74.1224 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 4 |
78-93-3 |
2-butanone
|
C4H8O
|
72.1066 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 5 |
106-95-6 |
3-bromopropene
|
C3H5Br
|
120.99 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 6 |
88-12-0 |
1-vinyl-2-pyrrolidinone
|
C6H9NO
|
111.1432 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 7 |
107-05-1 |
3-chloropropene
|
C3H5Cl
|
76.53 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 8 |
107-87-9 |
2-pentanone
|
C5H10O
|
86.1334 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 9 |
110-75-8 |
2-Chloroethyl vinyl ether
|
C4H7ClO
|
106.5517 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 10 |
71-36-3 |
1-butanol
|
C4H10O
|
74.12 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 11 |
108-83-8 |
2,6-Dimethyl-4-heptanone
|
C9H18O
|
142.24 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 12 |
97-86-9 |
isobutyl methacrylate
|
C8H14O2
|
142.20 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 13 |
123-96-6 |
2-octanol
|
C8H18O
|
130.22 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 14 |
108-10-1 |
4-methyl-2-pentanone
|
C6H12O
|
100.16 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 15 |
96-22-0 |
3-pentanone
|
C5H10O
|
86.1334 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 16 |
111-13-7 |
2-octanone
|
C8H16O
|
128.21 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 17 |
95-51-2 |
2-chloroaniline
|
C6H6ClN
|
127.5731 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 18 |
108-88-3 |
toluene
|
C7H8
|
92.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 19 |
80-62-6 |
methyl methacrylate
|
C5H8O2
|
100.12 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 20 |
140-88-5 |
ethyl acrylate
|
C5H8O2
|
100.11 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 21 |
100-43-6 |
4-vinylpyridine
|
C7H7N
|
105.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 22 |
79-10-7 |
acrylic acid
|
C3H4O2
|
72.06 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 23 |
79-41-4 |
methacrylic acid
|
C4H6O2
|
86.09 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 24 |
115-19-5 |
3-methyl butynol
|
C5H8O
|
84.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 25 |
89-98-5 |
2-chlorobenzaldehyde
|
C7H5ClO
|
140.6 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 26 |
111-87-5 |
octyl alcohol
|
C8H18O
|
130.22 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 27 |
93-58-3 |
methyl benzoate
|
C8H8O2
|
136.15 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 28 |
109-16-0 |
triethylene glycol dimethacrylate
|
C14H22O6
|
286.33 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 29 |
112-30-1 |
1-decanol
|
C10H22O
|
158.28 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 30 |
60-12-8 |
phenethyl alcohol
|
C8H10O
|
122.1664 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 31 |
563-47-3 |
isobutenyl chloride
|
C4H7Cl
|
90.55 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 32 |
674-82-8 |
acetyl ketene
|
C4H4O2
|
84.04 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 33 |
1592-20-7 |
4-vinylbenzyl chloride
|
C9H9Cl
|
152.62 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 34 |
1663-39-4 |
tert-Butyl acrylate
|
C7H12O2
|
128.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 35 |
2150-02-9 |
di-2-mercaptoethyl ether
|
C4H10OS2
|
138.25 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 36 |
2051-76-5 |
acrylic anhydride
|
C6H6O3
|
126.10 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 37 |
2439-35-2 |
2-dimethylaminoethyl acrylate
|
C7H13NO2
|
143.19 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 38 |
2867-47-2 |
2-(dimethylamino)ethyl methacrylate
|
C8H15NO2
|
157.22 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 39 |
2680-03-7 |
N,N-dimethylacrylamide
|
C5H9NO
|
99.1322 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 40 |
3179-47-3 |
decyl methacrylate
|
C14H26O2
|
226.3582 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 41 |
3934-23-4 |
1H,1H-perfluorooctyl methacrylate
|
C12H7F15O2
|
468.1621 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 42 |
4813-57-4 |
octadecyl acrylate
|
C21H40O2
|
324.5458 |
|
|
|
|
GIF
PDB
|
| 43 |
4986-89-4 |
pentaerythritol tetraacrylate
|
C17H20O8
|
352.3402 |
|
|
|
|
GIF
PDB
|
| 44 |
5891-21-4 |
5-chloro-2-pentanone
|
C5H9ClO
|
120.5785 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 45 |
106-42-3 |
para-xylene
|
C8H10
|
106.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 46 |
108-38-3 |
meta-xylene
|
C8H10
|
106.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 47 |
95-47-6 |
ortho-xylene
|
C8H10
|
106.167 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 48 |
25346-32-1 |
2-chloro-4-methylpentane
|
C6H13Cl
|
120.62 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 49 |
3894-22-3 |
2-vinyl-1,3-dioxolane
|
C5H8O2
|
100.117 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 50 |
13162-05-5 |
N-vinylformamide
|
C3H5NO
|
71.003 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 51 |
107-06-2 |
1,2-dichloroethane
|
C2H4Cl2
|
98.96 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 52 |
100-42-5 |
styrene
|
C8H8
|
174.15 |
jpeg
JCAMP
|
jpeg
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 53 |
111-19-3 |
sebacoyl chloride
|
C10H16Cl2O2
|
239.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 54 |
106-50-3 |
para-phenylenediamine
|
C6H8N2
|
108.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 55 |
108-45-2 |
meta-phenylenediamine
|
C6H8N2
|
108.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 56 |
107-13-1 |
acrylonitrile
|
C3H3
|
53.06 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 57 |
141-32-2 |
butyl acrylate
|
C7H12O2
|
128.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 58 |
17435-77-7 |
ethyl 2-(chloromethyl)acrylate
|
C6H9ClO2
|
148.58 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 59 |
10029-04-6 |
ethyl 2-(hydroxymethyl)acrylate
|
C6H10O3
|
130.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 60 |
107-18-6 |
allyl alcohol
|
C3H6O
|
58.08 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 61 |
590-36-3 |
2-methyl-2-pentanol
|
C6H14
|
102.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 62 |
565-67-3 |
2-methyl-3-pentanol
|
C6H14O
|
102.176 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 63 |
556-82-1 |
3-methyl-2-buten-1-ol
|
C5H10O
|
86.1334 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 64 |
584-02-1 |
3-pentanol
|
C5H12O
|
88.17 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 65 |
108-11-2 |
methyl isobutyl carbinol
|
C6H14O
|
102.18 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 66 |
67-64-1 |
acetone
|
C3H6O
|
58.09 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 67 |
100-41-4 |
ethyl benzene
|
C8H10
|
106.16 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 68 |
6935-65-5 |
N,N,3-trimethyl-benzamide
|
C10H13NO
|
163.2188 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 69 |
134-62-3 |
N,N-diethyl-3-methylbenzamide
|
C12H17NO
|
191.26 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 70 |
119-36-8 |
methyl salicylate
|
C8H8O3
|
152.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 71 |
100-66-3 |
anisole
|
C7H8O
|
108.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 72 |
108-95-2 |
phenol
|
C6H6O
|
94.1128 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 73 |
100-51-6 |
benzyl alcohol
|
C7H8O
|
108.13 |
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
GIF
PDB
|
| 74 |
71-23-8 |
n-propanol
|
C3H8O
|
60.0956 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 75 |
78-86-4 |
2-chlorobutane
|
C4H9Cl
|
92.57 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 76 |
67-63-0 |
2-propanol
|
C3H8O
|
60.09 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 77 |
627-27-0 |
3-buten-1-ol
|
C4H8O
|
72.11 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 78 |
106-40-1 |
4-bromoaniline
|
C6H6BrN
|
172.03 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 79 |
563-80-4 |
Methyl Isopropyl Ketone
|
C5H10O
|
86.1334 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 80 |
108-24-7 |
acetic anhydride
|
C4H6O3
|
102.09 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 81 |
75-05-8 |
acetonitrile
|
C2H3N
|
41.05 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 82 |
77-79-2 |
3-sulfolene
|
C4H6O2S
|
118.16 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 83 |
141-78-6 |
ethyl acetate
|
C4H8O2
|
88.10 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 84 |
98-82-8 |
cumene
|
C9H12
|
120.1938 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 85 |
25322-68-3 |
polyethylene glycol
|
-[C2H6O2]n-
|
Variable |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
|
| 86 |
111-20-6 |
sebacic acid
|
C10H18O4
|
202.25 |
jpeg
JCAMP
|
|
|
|
GIF
PDB
|
| 87 |
110-15-6 |
succinic acid
|
C4H6O4
|
118.09 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
GIF
PDB
|
| 88 |
98-06-6 |
tert-butylbenzene
|
C10H14
|
134.2206 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 89 |
584-84-9 |
2,4-toluene diisocyanate
|
C9H6N2O2
|
174.15 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 90 |
76-84-6 |
triphenylmethanol
|
C19H16O
|
260.34 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 91 |
2432-99-7 |
11-aminoundecanoic acid
|
C11H23NO2
|
201.35 |
jpeg
JCAMP
|
|
|
|
GIF
PDB
|
| 92 |
80-05-7 |
bisphenol A
|
C15H16O2
|
228.28 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 93 |
107-21-1 |
ethylene glycol
|
C2H6O2
|
62.07 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 94 |
9003-20-7 |
polyvinyl acetate
|
-[C4H6O2]n-
|
86.0902 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
|
| 95 |
78-83-1 |
2-methyl-1-propanol
|
C4H10O
|
74.14 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 96 |
563-79-1 |
2,3-dimethyl-2-butene
|
C6H12
|
84.16 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 97 |
517-23-7 |
2-acetylbutyrolactone
|
C6H8O3
|
128.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 98 |
111-29-5 |
1,5-pentanediol
|
C5H12O2
|
104.17 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 99 |
65-85-0 |
benzoic acid
|
C7H6O2
|
122.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 100 |
75-65-0 |
t-butyl alcohol
|
C4H10O
|
74.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 101 |
78-76-2 |
2-bromobutane
|
C4H9Br
|
137.03 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 102 |
507-19-7 |
2-bromo-2-methylpropane
|
C4H9Br
|
137.04 |
jpeg
JCAMP
|
jpeg
JCAMP
|
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 103 |
507-20-0 |
2-chloro-2-methyl propane
|
C4H9Cl
|
92.58 |
|
|
|
|
GIF
PDB
|
| 104 |
102-54-5 |
ferrocene
|
C10H10Fe
|
186.03 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 105 |
1271-55-2 |
acetylferrocene
|
C12H12FeO
|
228.07 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 106 |
60-29-7 |
diethyl ether
|
C4H10O
|
74.1224 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 107 |
108-86-1 |
mono bromobenzene
|
C6H5Br
|
157.02 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 108 |
519-73-3 |
triphenylmethane
|
C19H16
|
244.34 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
PDB
|
| 109 |
124-04-9 |
adipic acid
|
C6H10O4
|
146.14 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 110 |
144-62-7 |
oxalic acid
|
C2H2O4
|
90.04 |
jpeg
JCAMP
|
|
|
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 111 |
100-21-0 |
terephthalic acid
|
C8H6O4
|
166.13 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 112 |
121-91-5 |
isophthalic acid
|
C8H6O4
|
166.13 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
GIF
PDB
|
| 113 |
62-53-3 |
aniline
|
C6H7N
|
93.12 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 114 |
111-50-2 |
adipoyl dhloride
|
C6H8Cl2O2
|
183.03 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 115 |
124-09-4 |
1,6-hexanediamine
|
C6H16N2
|
116.2058 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 116 |
96-48-0 |
gamma-butyrolactone
|
C4H6O2
|
86.10 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 117 |
108-31-6 |
maleic anhydride
|
C4H2O3
|
98.06 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 118 |
57-13-6 |
urea
|
CH4N2
|
60.06 |
jpeg
JCAMP
|
|
|
|
GIF
PDB
|
| 119 |
9011-14-7 |
poly(methyl methacrylate)
|
C5H8O2
|
100.117 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
JCAMP
|
|
|
| 120 |
9002-86-2 |
poly(vinyl chloride)
|
C2H3Cl
|
62.4987 |
jpeg
JCAMP
|
|
|
|
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 121 |
9002-89-5 |
polyvinyl alcohol
|
C2H4
|
44.053 |
jpeg
JCAMP
|
|
|
|
|
| 122 |
67-66-3 |
trichloromethane
|
CHCl3
|
119.39 |
jpeg
JCAMP
|
|
|
jpeg
JCAMP
|
GIF
PDB
|
| 123 |
67-68-5 |
dimethylsulfoxide
|
C2H6OS
|
78.1288 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 124 |
56-23-5 |
carbon tetrachloride
|
CCl4
|
153.24 |
jpeg
JCAMP
|
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 125 |
PSLC-1 |
55:45 WOOL/NYLON FABRIC
|
Polymer Blend
|
NA |
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 126 |
75-26-3 |
2-Bromopropane
|
C3H7Br
|
122.9923 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 127 |
106-94-5 |
1-Bromopropane
|
C3H7BR
|
122.9923 |
jpeg
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 128 |
79-06-1 |
Acrylamide
|
C3H5NO
|
71.08 |
jpeg
JCAMP
|
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 129 |
136-60-7 |
n-Butyl Benzoate
|
C11H14O2
|
178.2304 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 130 |
94-46-2 |
Isoamyl Benzoate
|
C12H16O2
|
192.2572 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 131 |
123-51-3 |
Isoamyl Alcohol
|
C5H12O
|
88.1492 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 132 |
3306-36-3 |
sec-butyl benzoate
|
C11H14O2
|
178.23 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 133 |
598-72-1 |
2-bromopropanoic acid
|
C3H5BrO2
|
152.9753 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 134 |
64-04-0 |
Phenethylamine
|
C8H11N
|
121.1816 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 135 |
98-86-2 |
acetophenone
|
C8H8O
|
120.1506 |
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 136 |
108-03-2 |
1-nitropropane
|
C3H7NO2
|
89.0938 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 137 |
765-43-5 |
cyclopropylmethylketone
|
C5H8O
|
84.1176 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 138 |
536-74-3 |
phenylacetylene
|
C8H6
|
102.1354 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 139 |
79-09-4 |
propanoic acid
|
C3H6O2
|
74.092 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 140 |
123-38-6 |
propanal
|
C3H6O
|
58.0798 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 141 |
18707-60-3 |
methyl crotonate
|
C5H8O2
|
100.117 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 142 |
109-69-3 |
1-chlorobutane
|
C4H9Cl
|
92.5681 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 143 |
109-70-6 |
1-bromo-3-chloropropane
|
C3H6BrCl
|
157.4374 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
GIF
PDB
|
| 144 |
reskit01 |
Polystyrene (General Purpose)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 145 |
reskit02 |
Polystyrene (Medium Impact)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 146 |
reskit03 |
Polystyrene (High Impact)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 147 |
reskit04 |
Styrene Acrylonitrile (SAN)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 148 |
reskit06 |
Acrylonitrile Butadiene Styrene (Medium Impact)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 149 |
reskit07 |
Acrylonitrile Butadiene Styrene (High Impact)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 150 |
reskit08 |
Styrene Butadiene
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 151 |
reskit09 |
Acrylic
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 152 |
reskit10 |
Modified Acrylic
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 153 |
reskit11 |
Cellulose Acetate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 154 |
reskit12 |
Cellulose Acetate Butyrate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 155 |
reskit13 |
Cellulose Acetate Propionate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 156 |
reskit14 |
Nylon (Transparent)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 157 |
reskit15 |
Nylon Type 66
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 158 |
reskit16 |
Nylon Type 6
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 159 |
reskit17 |
Thermoplastic Polyester PBT
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 160 |
reskit18 |
Thermoplastic Polyester PETG
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 161 |
reskit19 |
Phenylene Oxide
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 162 |
reskit20 |
Polycarbonate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 163 |
reskit21 |
Polysulfone
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 164 |
reskit22 |
Polybutylene
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 165 |
reskit23 |
Ionomer
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 166 |
reskit24 |
Polyethylene (Low Density)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 167 |
reskit25 |
Polyethylene (High Density)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
GIF
|
| 168 |
reskit26 |
Polypropylene (co-polymer)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 169 |
reskit27 |
Polypropylene (homo-polymer)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 170 |
reskit28 |
Polyaryl Ether
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 171 |
reskit30 |
Polyvinyl Chloride (Rigid)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 172 |
reskit31 |
Acetal Resin (Homo-polymer)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 173 |
reskit32 |
Acetal Resin (Co-polymer)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 174 |
reskit29 |
Polyvinyl Chloride (Soft)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 175 |
reskit33 |
Polyphenylene Sulfide
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 176 |
reskit34 |
Ethylene Vinyl Acetate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 177 |
reskit35 |
Synthetic Elastomer
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 178 |
reskit36 |
Urethane Elastomer (Polyester)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 179 |
reskit37 |
Urethane Elastomer (Polyether)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 180 |
reskit38 |
Polyarylate
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 181 |
reskit39 |
Polyester Elastomer
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 182 |
reskit40 |
ABS (Flame Retardant)
|
|
|
|
|
jpeg
FID
|
|
|
| 183 |
reskit41 |
Polyallomer
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 184 |
reskit42 |
Styrenic Terpolymer
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 185 |
reskit43 |
Polymethyl Pentene
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 186 |
reskit44 |
Polypropylene (Talc Reinforced)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 187 |
reskit45 |
Polypropylene (Calcium Carbonate Reinf.)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 188 |
reskit47 |
Nylon Type 66 (33% glass)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 189 |
reskit48 |
Thermoplastic Rubber
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 190 |
reskit49 |
Polyethylene (Medium Density)
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| Index |
CAS Reg. Num. |
Name |
Formula |
MW |
IR |
H1 NMR |
C13 NMR |
mass spec |
Struc. |
| 191 |
reskit50 |
ABS-Nylon Alloy
|
|
|
|
|
jpeg
FID
JCAMP
|
|
|
| 192 |
9003-01-4 |
poly(acrylic acid)
|
C3H4O2
|
72 |
|
|
jpeg
|
|
|
| 193 |
597-96-6 |
3-Methyl-3-hexanol
|
C7H16O
|
116.2028 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
|
| 194 |
590-01-2 |
n-butyl propanoate
|
C7H14O2
|
130.1864 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
JCAMP
|
|
| 195 |
75-85-4 |
2-methyl-2-butanol
|
C5H12O
|
88.1492 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 196 |
23418-37-3 |
4-methyl-4-octanol
|
C9H20O
|
144.2564 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
|
| 197 |
598-01-6 |
4-methyl-4-heptanol
|
C8H18O
|
130.2296 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
|
| 198 |
5582-82-1 |
3-methyl-3-heptanol
|
C8H18O
|
130.2296 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 199 |
625-23-0 |
2-methyl-2-hexanol
|
C7H16O
|
116.2028 |
jpeg
JCAMP
|
jpeg
FID
JCAMP
|
jpeg
FID
JCAMP
|
|
GIF
PDB
|
| 200 |
110-91-8 |
morpholine
|
C4H9NO
|
87.1212 |
|
|
|
|
|