SpectraBase Spectrum ID |
Jt2o9j2zpxx |
Name |
3-Cyclopentylpropionamide, 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 |
287.224914557 u |
Formula |
C19H29NO |
InChI |
InChI=1S/C19H29NO/c1-2-15-20(16-14-18-8-4-3-5-9-18)19(21)13-12-17-10-6-7-11-17/h3-5,8-9,17H,2,6-7,10-16H2,1H3 |
InChIKey |
WLKCPXQEIJKKQN-UHFFFAOYSA-N |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)CCC1CCCC1)CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905392 |