![benzo[b]thiophene-5-carboxylic acid](/api/spectrum/1xfIbh2xj79/structure.png?h=300&w=458 "benzo[b]thiophene-5-carboxylic acid")
| SpectraBase Compound ID | C3wQvwI1Nwn |
|---|---|
| InChI | InChI=1S/C9H6O2S/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5H,(H,10,11) |
| InChIKey | SNBYTKLWZRHESA-UHFFFAOYSA-N |
| Mol Weight | 178.2 g/mol |
| Molecular Formula | C9H6O2S |
| Exact Mass | 178.008851 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1xfIbh2xj79 |
|---|---|
| Name | benzo[b]thiophene-5-carboxylic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6O2S |
| InChI | InChI=1S/C9H6O2S/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5H,(H,10,11) |
| InChIKey | SNBYTKLWZRHESA-UHFFFAOYSA-N |
| Molecular Weight | 178.205 g/mol |
| SMILES | OC(=O)c1ccc2sccc2c1 |
| SPLASH | splash10-01t9-4900000000-4fbc834752a6e3adaa63 |
| Source of Spectrum | JX-2012-732 |
| Synonyms | 1-Benzothiophene-5-carboxylic acid |
| Wiley ID | 1661178 |