| SpectraBase Spectrum ID |
7R6jxIXH7hp |
| Name |
2,6-Dimethylbenzonitrile |
| Alternate Name(s) |
2,6-Dimethylbenzenecarbonitrile
Benzonitrile, 2,6-dimethyl-
EINECS 229-503-5
NSC 98304 |
| CAS Registry Number |
6575-13-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9N |
| InChI |
InChI=1S/C9H9N/c1-7-4-3-5-8(2)9(7)6-10/h3-5H,1-2H3 |
| InChIKey |
QSACPWSIIRFHHR-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol1028892 |
| Molecular Weight |
131.178 g/mol |
| SMILES |
c1(c(c(C)ccc1)C#N)C |
| SPLASH |
splash10-0159-0900000000-2a4191410c6bdf2b93ed |
| Source of Spectrum |
A1-13-648/SMS10-Table2,entry16 |
| Wiley ID |
1749865 |
