| SpectraBase Spectrum ID |
JBEtjaiyuqp |
| Name |
4,5-Dimethyl ethyl 2-cyanobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NO2 |
| InChI |
InChI=1S/C12H13NO2/c1-4-15-12(14)11-6-9(3)8(2)5-10(11)7-13/h5-6H,4H2,1-3H3 |
| InChIKey |
CCMLMJZXVPCZSG-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol5026519 |
| Molecular Weight |
203.241 g/mol |
| SMILES |
c1(cc(C#N)c(C(=O)OCC)cc1C)C |
| SPLASH |
splash10-0pe9-0900000000-cc0fe3ed94017ce7d682 |
| Source of Spectrum |
A1-16-5220/SMS5-2j |
| Synonyms |
Ethyl 2-cyano-4,5-dimethylbenzoate |
| Wiley ID |
1751396 |
