| SpectraBase Compound ID | 3z1gAquwrgz |
|---|---|
| InChI | InChI=1S/C13H11N3O3S/c1-19-12(18)7-8-6-11(17)16(15-8)13-14-9-4-2-3-5-10(9)20-13/h2-6,17H,7H2,1H3 |
| InChIKey | YPKXMSZQYRTVNO-UHFFFAOYSA-N |
| Mol Weight | 289.31 g/mol |
| Molecular Formula | C13H11N3O3S |
| Exact Mass | 289.052112 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JnMikG76rLO |
|---|---|
| Name | (1-Benzothiazol-2-yl-5-hydroxy-1H-pyrazol-3-yl)acetic acid, methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H11N3O3S |
| InChI | InChI=1S/C13H11N3O3S/c1-19-12(18)7-8-6-11(17)16(15-8)13-14-9-4-2-3-5-10(9)20-13/h2-6,17H,7H2,1H3 |
| InChIKey | YPKXMSZQYRTVNO-UHFFFAOYSA-N |
| Molecular Weight | 289.309 g/mol |
| SMILES | Oc1[n](-c2nc3ccccc3s2)nc(CC(=O)OC)c1 |
| SPLASH | splash10-000i-6590000000-bdaf115814b47c60801e |
| Wiley ID | 1446347 |