| SpectraBase Spectrum ID |
9NUCvpTXMqX |
| Name |
6-methyl-4-benzo[e][1]benzothiolecarbonitrile |
| Alternate Name(s) |
6-methylbenzo[e]benzothiophene-4-carbonitrile
6-methylbenzo[e][1]benzothiole-4-carbonitrile |
| CAS Registry Number |
107971-25-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H9NS |
| InChI |
InChI=1S/C14H9NS/c1-9-3-2-4-11-12-5-6-16-14(12)10(8-15)7-13(9)11/h2-7H,1H3 |
| InChIKey |
LQAQNYOHKYKRJY-UHFFFAOYSA-N |
| Molecular Weight |
223.293 g/mol |
| SMILES |
c12c(c(C#N)cc3c2cccc3C)scc1 |
| SPLASH |
splash10-00di-0090000000-4a913bac0a40bc5a22e8 |
| Source of Spectrum |
Y-23-1231-25 |
| Wiley ID |
1224142 |
![6-methyl-4-benzo[e][1]benzothiolecarbonitrile](/api/spectrum/9NUCvpTXMqX/structure.png?h=300&w=458 "6-methyl-4-benzo[e][1]benzothiolecarbonitrile")
