SpectraBase Spectrum ID |
8vwMZSw4IXk |
Name |
Valeramide, N-allyl-N-(3-methylbutyl)-5-phenyl- |
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/c1-4-15-20(16-14-17(2)3)19(21)13-9-8-12-18-10-6-5-7-11-18/h4-7,10-11,17H,1,8-9,12-16H2,2-3H3 |
InChIKey |
HSMSITQZIJLRJQ-UHFFFAOYSA-N |
SMILES |
C(N(CCC(C)C)CC=C)(=O)CCCCC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971618 |