| SpectraBase Spectrum ID |
8kxOnKW2qyg |
| Name |
1-Methyl-3-(1-cyano-2-methylthio-4-oxopent-1-ene)indole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16N2OS |
| InChI |
InChI=1S/C16H16N2OS/c1-11(19)8-16(20-3)13(9-17)14-10-18(2)15-7-5-4-6-12(14)15/h4-7,10H,8H2,1-3H3/b16-13+ |
| InChIKey |
GWHYXFCFMKAWOG-DTQAZKPQSA-N |
| Molecular Weight |
284.377 g/mol |
| SMILES |
c1(\C(=C/(CC(=O)C)SC)C#N)c[n](C)c2c1cccc2 |
| SPLASH |
splash10-0006-0940000000-d11341aae49b7c4fa96b |
| Source of Spectrum |
AT-38-3122-3a |
| Wiley ID |
853833 |
