![5-Nitrobenzo[b]thiophene-2-thiol](/api/spectrum/JEj2whItNpg/structure.png?h=300&w=458 "5-Nitrobenzo[b]thiophene-2-thiol")
| SpectraBase Compound ID | NCC7Y9BTMa |
|---|---|
| InChI | InChI=1S/C8H5NO2S2/c10-9(11)6-1-2-7-5(3-6)4-8(12)13-7/h1-4,12H |
| InChIKey | NQEARIMQZWVBIC-UHFFFAOYSA-N |
| Mol Weight | 211.25 g/mol |
| Molecular Formula | C8H5NO2S2 |
| Exact Mass | 210.976171 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JEj2whItNpg |
|---|---|
| Name | 5-Nitrobenzo[b]thiophene-2-thiol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NO2S2 |
| InChI | InChI=1S/C8H5NO2S2/c10-9(11)6-1-2-7-5(3-6)4-8(12)13-7/h1-4,12H |
| InChIKey | NQEARIMQZWVBIC-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/ol401981w |
| Molecular Weight | 211.253 g/mol |
| SMILES | Sc1sc2ccc(cc2c1)[N+](=O)[O-] |
| SPLASH | splash10-001i-9320000000-d5b7f3a67c47aeb39bfa |
| Source of Spectrum | A1-15-4038/SMS6-8 |
| Wiley ID | 1749018 |