SpectraBase Spectrum ID |
Ctp4PTcEEoS |
Name |
Butyramide, 2-phenyl-N-propyl-N-(hept-2-yl)- |
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/c1-5-8-10-13-17(4)21(16-6-2)20(22)19(7-3)18-14-11-9-12-15-18/h9,11-12,14-15,17,19H,5-8,10,13,16H2,1-4H3 |
InChIKey |
CDJGNIDWDCVHEA-UHFFFAOYSA-N |
SMILES |
C(N(CCC)C(CCCCC)C)(=O)C(CC)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910853 |