| SpectraBase Compound ID | 7aVw1C8HD1v |
|---|---|
| InChI | InChI=1S/C18H23NO3S/c1-12(2)15-11-18(14(4)10-17(15)22-5)23(20,21)19-16-9-7-6-8-13(16)3/h6-12,19H,1-5H3 |
| InChIKey | OPWWQLKMWVXYAB-UHFFFAOYSA-N |
| Mol Weight | 333.45 g/mol |
| Molecular Formula | C18H23NO3S |
| Exact Mass | 333.139865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IC6rv88RxQZ |
|---|---|
| Name | 5-Isopropyl-4-methoxy-2-methyl-N-(2-methylphenyl)benzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.139864776 u |
| Formula | C18H23NO3S |
| InChI | InChI=1S/C18H23NO3S/c1-12(2)15-11-18(14(4)10-17(15)22-5)23(20,21)19-16-9-7-6-8-13(16)3/h6-12,19H,1-5H3 |
| InChIKey | OPWWQLKMWVXYAB-UHFFFAOYSA-N |
| SMILES | N(S(C=1C=C(C(C)C)C(=CC1C)OC)(=O)=O)C=1C(C)=CC=CC1 |