| SpectraBase Compound ID | 83bU4shjkB2 |
|---|---|
| InChI | InChI=1S/C10H13NO4/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3,(H2,11,12) |
| InChIKey | GGNMTJKRHHLJHH-UHFFFAOYSA-N |
| Mol Weight | 211.22 g/mol |
| Molecular Formula | C10H13NO4 |
| Exact Mass | 211.084458 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BkH7atUqoER |
|---|---|
| Name | 3,4,5-Trimethoxybenzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.084457899 u |
| Formula | C10H13NO4 |
| InChI | InChI=1S/C10H13NO4/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3,(H2,11,12) |
| InChIKey | GGNMTJKRHHLJHH-UHFFFAOYSA-N |
| Molecular Weight | 211.217 g/mol |
| SMILES | NC(C1=CC(=C(C(=C1)OC)OC)OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.989373 |