![Methyl 2-[(phenylsulfonyl)amino]benzoate, acetate](/api/spectrum/AXG1ZKOJrqi/structure.png?h=300&w=458 "Methyl 2-[(phenylsulfonyl)amino]benzoate, acetate")
| SpectraBase Compound ID | JooTZ8a2P5V |
|---|---|
| InChI | InChI=1S/C16H15NO5S/c1-12(18)17(23(20,21)13-8-4-3-5-9-13)15-11-7-6-10-14(15)16(19)22-2/h3-11H,1-2H3 |
| InChIKey | AWRNJNWDJOBKCA-UHFFFAOYSA-N |
| Mol Weight | 333.36 g/mol |
| Molecular Formula | C16H15NO5S |
| Exact Mass | 333.067094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AXG1ZKOJrqi |
|---|---|
| Name | Methyl 2-[(phenylsulfonyl)amino]benzoate, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.067093756 u |
| Formula | C16H15NO5S |
| InChI | InChI=1S/C16H15NO5S/c1-12(18)17(23(20,21)13-8-4-3-5-9-13)15-11-7-6-10-14(15)16(19)22-2/h3-11H,1-2H3 |
| InChIKey | AWRNJNWDJOBKCA-UHFFFAOYSA-N |
| Molecular Weight | 333.358 g/mol |
| SMILES | C1(N(S(=O)(=O)C2=CC=CC=C2)C(C)=O)=C(C=CC=C1)C(=O)OC |