| SpectraBase Spectrum ID |
4dQ1WMfdKNQ |
| Name |
Methyl-5-carboxylate-2-(phenylsulfanyl)-1H-indole |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13NO2S |
| InChI |
InChI=1S/C16H13NO2S/c1-19-16(18)11-7-8-14-12(9-11)10-15(17-14)20-13-5-3-2-4-6-13/h2-10,17H,1H3 |
| InChIKey |
AVQDWLDGKVNBIE-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1039/C5CC05421D |
| Molecular Weight |
283.345 g/mol |
| SMILES |
[nH]1c(cc2c1ccc(c2)C(=O)OC)Sc1ccccc1 |
| SPLASH |
splash10-0ff0-1190000000-7944a3fa839ac2655ff9 |
| Source of Spectrum |
KD-51-13898/SM13-2ha |
| Synonyms |
Methyl 2-(phenylthio)-1H-indole-5-carboxylate |
| Wiley ID |
1800865 |
