| SpectraBase Spectrum ID |
KKCT8uYLuOB |
| Name |
S-Methyl 4-cyanobenzothioate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H7NOS |
| InChI |
InChI=1S/C9H7NOS/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,1H3 |
| InChIKey |
FBYKABKYFULMLJ-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu 2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.1c00665 |
| Molecular Weight |
177.221 g/mol |
| Reported Formula |
C9H7NOS |
| SMILES |
CSC(c1ccc(cc1)C#N)=O |
| SPLASH |
splash10-001i-1900000000-b9ca45ec92d5ad6a7113 |
| Source of Spectrum |
JOC-86-8801-3o |
| Wiley ID |
1867847 |
