| SpectraBase Compound ID | 5BRJlu9ecre |
|---|---|
| InChI | InChI=1S/C22H29NO/c1-4-5-7-12-19(3)23(17-20-13-8-6-9-14-20)22(24)21-15-10-11-18(2)16-21/h6,8-11,13-16,19H,4-5,7,12,17H2,1-3H3 |
| InChIKey | JQVGXQBULPGJBU-UHFFFAOYSA-N |
| Mol Weight | 323.48 g/mol |
| Molecular Formula | C22H29NO |
| Exact Mass | 323.224915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JbvZBmFM4NF |
|---|---|
| Name | Benzamide, 3-methyl-N-benzyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.224914557 u |
| Formula | C22H29NO |
| InChI | InChI=1S/C22H29NO/c1-4-5-7-12-19(3)23(17-20-13-8-6-9-14-20)22(24)21-15-10-11-18(2)16-21/h6,8-11,13-16,19H,4-5,7,12,17H2,1-3H3 |
| InChIKey | JQVGXQBULPGJBU-UHFFFAOYSA-N |
| Molecular Weight | 323.480 g/mol |
| SMILES | C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)C=1C=C(C=CC1)C |