| SpectraBase Compound ID | 6i7n59HfsTH |
|---|---|
| InChI | InChI=1S/C8H5NO2S/c10-8(11)5-1-2-7-6(3-5)9-4-12-7/h1-4H,(H,10,11) |
| InChIKey | RBIZQDIIVYJNRS-UHFFFAOYSA-N |
| Mol Weight | 179.19 g/mol |
| Molecular Formula | C8H5NO2S |
| Exact Mass | 179.0041 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GCgQeBljLV4 |
|---|---|
| Name | Benzothiazole-5-carboxylic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NO2S |
| InChI | InChI=1S/C8H5NO2S/c10-8(11)5-1-2-7-6(3-5)9-4-12-7/h1-4H,(H,10,11) |
| InChIKey | RBIZQDIIVYJNRS-UHFFFAOYSA-N |
| Molecular Weight | 179.193 g/mol |
| SMILES | OC(c1ccc2scnc2c1)=O |
| SPLASH | splash10-01t9-1900000000-5726efb5c652c111f1f1 |
| Source of Spectrum | NP-2-9097-0 |
| Wiley ID | 1101876 |