| SpectraBase Spectrum ID |
doxocLhKNU |
| Name |
2-Methylpropanamide, N-(2-phenylethyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.240564621 u |
| Formula |
C19H31NO |
| InChI |
InChI=1S/C19H31NO/c1-4-5-6-7-11-15-20(19(21)17(2)3)16-14-18-12-9-8-10-13-18/h8-10,12-13,17H,4-7,11,14-16H2,1-3H3 |
| InChIKey |
HACMEPXVPQLABR-UHFFFAOYSA-N |
| Molecular Weight |
289.463 g/mol |
| SMILES |
C(C)(C(N(CCCCCCC)CCC1=CC=CC=C1)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967135 |
