| SpectraBase Compound ID | AivPCMVHGR2 |
|---|---|
| InChI | InChI=1S/C16H16N2O6/c1-22-13-7-10(8-14(23-2)15(13)24-3)16(19)17-11-5-4-6-12(9-11)18(20)21/h4-9H,1-3H3,(H,17,19) |
| InChIKey | XASHOUQQWOXQNP-UHFFFAOYSA-N |
| Mol Weight | 332.31 g/mol |
| Molecular Formula | C16H16N2O6 |
| Exact Mass | 332.100836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DZg4jmBlDoN |
|---|---|
| Name | 3'-Nitro-3,4,5-trimethoxybenzanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.100836237 u |
| Formula | C16H16N2O6 |
| InChI | InChI=1S/C16H16N2O6/c1-22-13-7-10(8-14(23-2)15(13)24-3)16(19)17-11-5-4-6-12(9-11)18(20)21/h4-9H,1-3H3,(H,17,19) |
| InChIKey | XASHOUQQWOXQNP-UHFFFAOYSA-N |
| Molecular Weight | 332.312 g/mol |
| SMILES | N(C(C=1C=C(C(=C(C1)OC)OC)OC)=O)C1=CC=CC(=C1)N(=O)=O |