| SpectraBase Spectrum ID |
IDXeuEOTzgb |
| Name |
3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-propyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.256214686 u |
| Formula |
C20H33NO |
| InChI |
InChI=1S/C20H33NO/c1-6-13-21(14-12-18-10-8-7-9-11-18)19(22)15-17(2)16-20(3,4)5/h7-11,17H,6,12-16H2,1-5H3 |
| InChIKey |
VHQFJHSFGAZCIO-UHFFFAOYSA-N |
| SMILES |
C(CC(CC(N(CCC)CCC1=CC=CC=C1)=O)C)(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888842 |
