| SpectraBase Compound ID | 2ir4Qa1J2V0 |
|---|---|
| InChI | InChI=1S/C8H7NOS2/c10-5-9-6-3-1-2-4-7(6)12-8(9)11/h1-4,10H,5H2 |
| InChIKey | SDMPSCVFJMUEOS-UHFFFAOYSA-N |
| Mol Weight | 197.27 g/mol |
| Molecular Formula | C8H7NOS2 |
| Exact Mass | 196.996906 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 | 16pAAZYEkgM |
|---|---|
| Name | 3-(hydroxymethyl)-1,3-benzothiazole-2-thione |
| Alternate Name(s) | 3-Methylol-1,3-benzothiazole-2-thione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NOS2 |
| InChI | InChI=1S/C8H7NOS2/c10-5-9-6-3-1-2-4-7(6)12-8(9)11/h1-4,10H,5H2 |
| InChIKey | SDMPSCVFJMUEOS-UHFFFAOYSA-N |
| Molecular Weight | 197.270 g/mol |
| SMILES | OCN1C(Sc2c1cccc2)=S |
| SPLASH | splash10-014i-3900000000-689d88c631ab46a5b1cf |
| Source of Spectrum | IC-469-0-0 |
| Wiley ID | 1194234 |