SpectraBase Spectrum ID |
9lbOXRq6zAz |
Name |
Butyramide, 4-phenyl-N-propyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.209264492 u |
Formula |
C17H27NO |
InChI |
InChI=1S/C17H27NO/c1-4-13-18(14-15(2)3)17(19)12-8-11-16-9-6-5-7-10-16/h5-7,9-10,15H,4,8,11-14H2,1-3H3 |
InChIKey |
OJTJRPARGVLREO-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C(C(N(CC(C)C)CCC)=O)CCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901616 |