| SpectraBase Compound ID | DREl4ItTxB9 |
|---|---|
| InChI | InChI=1S/C15H14N2O3/c1-16(11-12-5-3-2-4-6-12)15(18)13-7-9-14(10-8-13)17(19)20/h2-10H,11H2,1H3 |
| InChIKey | CTSLMCFVBVCVMA-UHFFFAOYSA-N |
| Mol Weight | 270.29 g/mol |
| Molecular Formula | C15H14N2O3 |
| Exact Mass | 270.100442 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4eVEekMfvQ1 |
|---|---|
| Name | Benzamide, 4-nitro-N-benzyl-N-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.100442316 u |
| Formula | C15H14N2O3 |
| InChI | InChI=1S/C15H14N2O3/c1-16(11-12-5-3-2-4-6-12)15(18)13-7-9-14(10-8-13)17(19)20/h2-10H,11H2,1H3 |
| InChIKey | CTSLMCFVBVCVMA-UHFFFAOYSA-N |
| SMILES | C(N(CC1=CC=CC=C1)C)(=O)C1=CC=C(C=C1)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.84804 |