| SpectraBase Spectrum ID |
ERobyCmczkr |
| Name |
Dimethyl 1-methyl-5-phenyl-2-(phenylthio)-1H-pyrrole-3,4-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19NO4S |
| InChI |
InChI=1S/C21H19NO4S/c1-22-18(14-10-6-4-7-11-14)16(20(23)25-2)17(21(24)26-3)19(22)27-15-12-8-5-9-13-15/h4-13H,1-3H3 |
| InChIKey |
UUHDQFIRKPCTJN-UHFFFAOYSA-N |
| Molecular Weight |
381.446 g/mol |
| SMILES |
c1(c(c(-c2ccccc2)[n](c1Sc1ccccc1)C)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-001i-0009000000-1ac60d2d8ae31670f5a2 |
| Source of Spectrum |
F-51-7027-4 |
| Synonyms |
dimethyl 1-methyl-2-phenyl-5-(phenylsulfanyl)-1H-pyrrole-3,4-dicarboxylate |
| Wiley ID |
792417 |
