| SpectraBase Spectrum ID |
7tbCLROnH04 |
| Name |
4-benzo[e][1]benzothiolecarbonitrile |
| Alternate Name(s) |
benzo[e]benzothiophene-4-carbonitrile
benzo[e][1]benzothiole-4-carbonitrile |
| CAS Registry Number |
37094-49-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H7NS |
| InChI |
InChI=1S/C13H7NS/c14-8-10-7-9-3-1-2-4-11(9)12-5-6-15-13(10)12/h1-7H |
| InChIKey |
KFNGVWVSOUYJAH-UHFFFAOYSA-N |
| Molecular Weight |
209.266 g/mol |
| SMILES |
c12c(c3ccccc3cc2C#N)ccs1 |
| SPLASH |
splash10-0a4i-0090000000-0dc8a7eead94f630eb39 |
| Source of Spectrum |
Y-23-1230-4 |
| Wiley ID |
1208243 |
![4-benzo[e][1]benzothiolecarbonitrile](/api/spectrum/7tbCLROnH04/structure.png?h=300&w=458 "4-benzo[e][1]benzothiolecarbonitrile")
