| SpectraBase Compound ID | DUBN4gGnOHe |
|---|---|
| InChI | InChI=1S/C14H12ClNOS/c1-9-2-5-11(6-3-9)18-14(17)12-7-4-10(15)8-13(12)16/h2-8H,16H2,1H3 |
| InChIKey | GXKAVFJLNNAWDV-UHFFFAOYSA-N |
| Mol Weight | 277.77 g/mol |
| Molecular Formula | C14H12ClNOS |
| Exact Mass | 277.032813 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HQlC21ZZpuL |
|---|---|
| Name | S-p-Tolyl 2-amino-4-chlorobenzothioate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H12ClNOS |
| InChI | InChI=1S/C14H12ClNOS/c1-9-2-5-11(6-3-9)18-14(17)12-7-4-10(15)8-13(12)16/h2-8H,16H2,1H3 |
| InChIKey | GXKAVFJLNNAWDV-UHFFFAOYSA-N |
| Molecular Weight | 277.769 g/mol |
| SMILES | Nc1c(C(Sc2ccc(cc2)C)=O)ccc(Cl)c1 |
| SPLASH | splash10-0udi-1910000000-811d2f1917ca82352d1d |
| Source of Spectrum | F-69-2287-3db |
| Wiley ID | 1737746 |