SpectraBase Spectrum ID |
IrI5ejUY1jl |
Name |
Benzamide, 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 |
275.224914557 u |
Formula |
C18H29NO |
InChI |
InChI=1S/C18H29NO/c1-5-7-9-12-16(4)19(15(3)6-2)18(20)17-13-10-8-11-14-17/h8,10-11,13-16H,5-7,9,12H2,1-4H3 |
InChIKey |
GRCFJYSGWQZDOL-UHFFFAOYSA-N |
SMILES |
C(N(C(CCCCC)C)C(CC)C)(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935264 |