| SpectraBase Compound ID | 8S96DQXrlDT |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-5-7-8-9-14-19(16(4)6-2)18(20)17-12-10-15(3)11-13-17/h10-13,16H,5-9,14H2,1-4H3 |
| InChIKey | IRKNMOHXNCVXGT-UHFFFAOYSA-N |
| Mol Weight | 275.44 g/mol |
| Molecular Formula | C18H29NO |
| Exact Mass | 275.224915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4xA2Rp4N3z1 |
|---|---|
| Name | Benzamide, 4-methyl-N-(2-butyl)-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.224914557 u |
| Formula | C18H29NO |
| InChI | InChI=1S/C18H29NO/c1-5-7-8-9-14-19(16(4)6-2)18(20)17-12-10-15(3)11-13-17/h10-13,16H,5-9,14H2,1-4H3 |
| InChIKey | IRKNMOHXNCVXGT-UHFFFAOYSA-N |
| SMILES | C(N(CCCCCC)C(CC)C)(=O)C=1C=CC(=CC1)C |