| SpectraBase Compound ID | ICboW12izxe |
|---|---|
| InChI | InChI=1S/C18H21NO/c1-3-5-15-8-10-17(11-9-15)18(20)19-13-16-7-4-6-14(2)12-16/h4,6-12H,3,5,13H2,1-2H3,(H,19,20) |
| InChIKey | QTFDMCGKXRNZOL-UHFFFAOYSA-N |
| Mol Weight | 267.37 g/mol |
| Molecular Formula | C18H21NO |
| Exact Mass | 267.162314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qMVVeLdaJ2 |
|---|---|
| Name | N-(3-Methylbenzyl)-4-propylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.162314299 u |
| Formula | C18H21NO |
| InChI | InChI=1S/C18H21NO/c1-3-5-15-8-10-17(11-9-15)18(20)19-13-16-7-4-6-14(2)12-16/h4,6-12H,3,5,13H2,1-2H3,(H,19,20) |
| InChIKey | QTFDMCGKXRNZOL-UHFFFAOYSA-N |
| Molecular Weight | 267.372 g/mol |
| SMILES | C=1(C(NCC2=CC(=CC=C2)C)=O)C=CC(=CC1)CCC |