SpectraBase Spectrum ID |
Y9qVFI6gMH |
Name |
Butyramide, 4-phenyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.162314299 u |
Formula |
C14H21NO |
InChI |
InChI=1S/C14H21NO/c1-12(2)11-15-14(16)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,15,16) |
InChIKey |
ULEYXYSLGQRTRI-UHFFFAOYSA-N |
Molecular Weight |
219.328 g/mol |
SMILES |
C(NCC(C)C)(=O)CCCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947175 |