![[(Phenylsulfonyl)amino]acetic acid, N-acetyl-](/api/spectrum/52xeYupqmG3/structure.png?h=300&w=458 "[(Phenylsulfonyl)amino]acetic acid, N-acetyl-")
| SpectraBase Compound ID | NGU0etn72f |
|---|---|
| InChI | InChI=1S/C10H11NO5S/c1-8(12)11(7-10(13)14)17(15,16)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14) |
| InChIKey | HMQYPDUDYHJZDA-UHFFFAOYSA-N |
| Mol Weight | 257.26 g/mol |
| Molecular Formula | C10H11NO5S |
| Exact Mass | 257.035794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 52xeYupqmG3 |
|---|---|
| Name | [(Phenylsulfonyl)amino]acetic acid, N-acetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.035793627 u |
| Formula | C10H11NO5S |
| InChI | InChI=1S/C10H11NO5S/c1-8(12)11(7-10(13)14)17(15,16)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14) |
| InChIKey | HMQYPDUDYHJZDA-UHFFFAOYSA-N |
| Molecular Weight | 257.260 g/mol |
| SMILES | C(N(S(=O)(=O)C1=CC=CC=C1)C(=O)C)C(=O)O |