| SpectraBase Compound ID | CkCmZYLRUmR |
|---|---|
| InChI | InChI=1S/C18H18N2O5S/c1-12-4-3-5-15(10-12)20-26(24,25)16-8-6-14(7-9-16)19-17(21)11-13(2)18(22)23/h3-10,20H,2,11H2,1H3,(H,19,21)(H,22,23) |
| InChIKey | SFZRVOYRBQWSOD-UHFFFAOYSA-N |
| Mol Weight | 374.41 g/mol |
| Molecular Formula | C18H18N2O5S |
| Exact Mass | 374.093643 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 31tH6mAqnsX |
|---|---|
| Name | 2-Methylene-4'-(m-tolylsulfamoyl)succinanilic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.093642857 u |
| Formula | C18H18N2O5S |
| InChI | InChI=1S/C18H18N2O5S/c1-12-4-3-5-15(10-12)20-26(24,25)16-8-6-14(7-9-16)19-17(21)11-13(2)18(22)23/h3-10,20H,2,11H2,1H3,(H,19,21)(H,22,23) |
| InChIKey | SFZRVOYRBQWSOD-UHFFFAOYSA-N |
| Molecular Weight | 374.411 g/mol |
| SMILES | N(S(C1=CC=C(C=C1)NC(CC(C(O)=O)=C)=O)(=O)=O)C=1C=C(C=CC1)C |