SpectraBase Spectrum ID |
JanivPi7a9P |
Name |
Benzamide, 4-ethyl-N-(2-butyl)-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/c1-6-9-10-11-17(5)21(16(4)7-2)20(22)19-14-12-18(8-3)13-15-19/h12-17H,6-11H2,1-5H3 |
InChIKey |
SMETXWYDRKVXNZ-UHFFFAOYSA-N |
SMILES |
C(N(C(CCCCC)C)C(CC)C)(=O)C=1C=CC(=CC1)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888496 |