| SpectraBase Spectrum ID |
B1Npsp6AKjQ |
| Name |
1-benzyl-2-(methylthio)-3-nitro-pyrrole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12N2O2S |
| InChI |
InChI=1S/C12H12N2O2S/c1-17-12-11(14(15)16)7-8-13(12)9-10-5-3-2-4-6-10/h2-8H,9H2,1H3 |
| InChIKey |
CCFIHPJWRJYONX-UHFFFAOYSA-N |
| Molecular Weight |
248.300 g/mol |
| SMILES |
c1([n](ccc1N(=O)=O)Cc1ccccc1)SC |
| SPLASH |
splash10-0002-0090000000-d7c68dfc1d46f618eba0 |
| Source of Spectrum |
SO-0-142-3 |
| Synonyms |
1-benzyl-2-methylsulfanyl-3-nitro-pyrrole
2-(methylthio)-3-nitro-1-(phenylmethyl)pyrrole
2-methylsulfanyl-3-nitro-1-(phenylmethyl)pyrrole |
| Wiley ID |
1540457 |
