| SpectraBase Spectrum ID |
Ck5g7VFk7on |
| Name |
1H-Indole-3-carbonitrile, 6-chloro-2-(methylthio)-1-phenyl- |
| Alternate Name(s) |
6-chloro-2-(methylsulfanyl)-1-phenyl-1H-indole-3-carbonitrile
6-Chloro-3-cyano-2-methylthio-1-phenylindole |
| CAS Registry Number |
115351-44-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11ClN2S |
| InChI |
InChI=1S/C16H11ClN2S/c1-20-16-14(10-18)13-8-7-11(17)9-15(13)19(16)12-5-3-2-4-6-12/h2-9H,1H3 |
| InChIKey |
MTFCNIGRJJPAPU-UHFFFAOYSA-N |
| Molecular Weight |
298.791 g/mol |
| SMILES |
c1(c(c2ccc(cc2[n]1-c1ccccc1)Cl)C#N)SC |
| SPLASH |
splash10-0002-0093000000-85cfe50e11fce6b7d34a |
| Source of Spectrum |
KC-1988-173-0 |
| Wiley ID |
1300802 |
