| SpectraBase Compound ID | 9pn360ZyNdR |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-4-5-14-19(15-13-16(2)3)18(20)12-11-17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3 |
| InChIKey | SBENEVMESCQTDX-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 | DBAi04CBFHP |
|---|---|
| Name | Propionamide, 3-phenyl-N-butyl-N-(3-methylbutyl)- |
| 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/c1-4-5-14-19(15-13-16(2)3)18(20)12-11-17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3 |
| InChIKey | SBENEVMESCQTDX-UHFFFAOYSA-N |
| SMILES | C(=O)(N(CCCC)CCC(C)C)CCC=1C=CC=CC1 |