| SpectraBase Spectrum ID |
B6qfqQrdcQP |
| Name |
3,4-Dihydro-5-(3-cyano-1-(4-methylphenylsulfonyl)pyrrol-2-yl)-2H-pyrrole |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.088497907 u |
| Formula |
C16H15N3O2S |
| InChI |
InChI=1S/C16H15N3O2S/c1-12-4-6-14(7-5-12)22(20,21)19-10-8-13(11-17)16(19)15-3-2-9-18-15/h4-8,10H,2-3,9H2,1H3 |
| InChIKey |
ODEBAVBWSAKZBE-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0001.318 |
| Molecular Weight |
313.375 g/mol |
| Quality |
15 |
| Reported Formula |
C16H16N3O2S |
| SMILES |
C=1(N(S(C2=CC=C(C=C2)C)(=O)=O)C=CC1C#N)C=1CCCN1 |
| SPLASH |
splash10-0006-0930000000-b61ded1cd00955b1d307 |
| Source of Spectrum |
ARK-2000-368-11 (DOI: 10.3998/ark.5550190.0001.318) |
| Wiley ID |
1908495 |
