![Butanoic acid, 3-hydroxy-2-{[(4-methylphenyl)sulfonyl]amino}-, methyl ester](/api/spectrum/9tSGp0Yhndr/structure.png?h=300&w=458 "Butanoic acid, 3-hydroxy-2-{[(4-methylphenyl)sulfonyl]amino}-, methyl ester")
| SpectraBase Compound ID | 1xXnGPCsLeU |
|---|---|
| InChI | InChI=1S/C12H17NO5S/c1-8-4-6-10(7-5-8)19(16,17)13-11(9(2)14)12(15)18-3/h4-7,9,11,13-14H,1-3H3 |
| InChIKey | BDDKVNRJMUPLMP-UHFFFAOYSA-N |
| Mol Weight | 287.33 g/mol |
| Molecular Formula | C12H17NO5S |
| Exact Mass | 287.082744 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9tSGp0Yhndr |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H17NO5S |
| InChI | InChI=1S/C12H17NO5S/c1-8-4-6-10(7-5-8)19(16,17)13-11(9(2)14)12(15)18-3/h4-7,9,11,13-14H,1-3H3 |
| InChIKey | BDDKVNRJMUPLMP-UHFFFAOYSA-N |
| Molecular Weight | 287.0823 |
| SMILES | N(C(C(O)C)C(OC)=O)S(=O)(=O)c1ccc(C)cc1 |
| SPLASH | splash10-000l-9100000000-c039c8a53a29bae9b6f5 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |