SpectraBase Spectrum ID |
LquqBNgWQvd |
Name |
Butyramide, 2-phenyl-N-(2-pentyl)-N-pentyl- |
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/c1-5-8-12-16-21(17(4)13-6-2)20(22)19(7-3)18-14-10-9-11-15-18/h9-11,14-15,17,19H,5-8,12-13,16H2,1-4H3 |
InChIKey |
QQSZPMLEONMYLX-UHFFFAOYSA-N |
SMILES |
C(N(CCCCC)C(CCC)C)(=O)C(CC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818752 |