| SpectraBase Compound ID | 4RCTsL5htmb |
|---|---|
| InChI | InChI=1S/C19H22N2O3/c1-2-3-7-14-20(15-16-8-5-4-6-9-16)19(22)17-10-12-18(13-11-17)21(23)24/h4-6,8-13H,2-3,7,14-15H2,1H3 |
| InChIKey | TWICJBAUARRNLG-UHFFFAOYSA-N |
| Mol Weight | 326.4 g/mol |
| Molecular Formula | C19H22N2O3 |
| Exact Mass | 326.163043 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LJITn1EHTC1 |
|---|---|
| Name | Benzamide, 4-nitro-N-benzyl-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.163042573 u |
| Formula | C19H22N2O3 |
| InChI | InChI=1S/C19H22N2O3/c1-2-3-7-14-20(15-16-8-5-4-6-9-16)19(22)17-10-12-18(13-11-17)21(23)24/h4-6,8-13H,2-3,7,14-15H2,1H3 |
| InChIKey | TWICJBAUARRNLG-UHFFFAOYSA-N |
| Molecular Weight | 326.396 g/mol |
| SMILES | C(N(CCCCC)CC1=CC=CC=C1)(=O)C=1C=CC(=CC1)N(=O)=O |