![Benzenesulfonamide, N-[(4-methoxyphenyl)methyl]-4-nitro-](/api/spectrum/HeoHhRvFBhD/structure.png?h=300&w=458 "Benzenesulfonamide, N-[(4-methoxyphenyl)methyl]-4-nitro-")
| SpectraBase Compound ID | Ii4pzE4VnTG |
|---|---|
| InChI | InChI=1S/C14H14N2O5S/c1-21-13-6-2-11(3-7-13)10-15-22(19,20)14-8-4-12(5-9-14)16(17)18/h2-9,15H,10H2,1H3 |
| InChIKey | RVRDNSLFNJNMLR-UHFFFAOYSA-N |
| Mol Weight | 322.34 g/mol |
| Molecular Formula | C14H14N2O5S |
| Exact Mass | 322.062343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HeoHhRvFBhD |
|---|---|
| Name | Benzenesulfonamide, N-[(4-methoxyphenyl)methyl]-4-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.062342728 u |
| Formula | C14H14N2O5S |
| InChI | InChI=1S/C14H14N2O5S/c1-21-13-6-2-11(3-7-13)10-15-22(19,20)14-8-4-12(5-9-14)16(17)18/h2-9,15H,10H2,1H3 |
| InChIKey | RVRDNSLFNJNMLR-UHFFFAOYSA-N |
| Molecular Weight | 322.335 g/mol |
| SMILES | COC=1C=CC(CNS(C2=CC=C(N(=O)=O)C=C2)(=O)=O)=CC1 |