SpectraBase Spectrum ID |
KXVFVGA3lhc |
Name |
Butyramide, 2-phenyl-N-(2-butyl)-N-pentyl- |
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/c1-5-8-12-15-20(16(4)6-2)19(21)18(7-3)17-13-10-9-11-14-17/h9-11,13-14,16,18H,5-8,12,15H2,1-4H3 |
InChIKey |
GCZOWEAOWYHYGT-UHFFFAOYSA-N |
Molecular Weight |
289.463 g/mol |
SMILES |
C(N(CCCCC)C(CC)C)(=O)C(CC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865935 |