SpectraBase Spectrum ID |
F3Hox2N9ASZ |
Name |
Benzamide, 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 |
261.209264492 u |
Formula |
C17H27NO |
InChI |
InChI=1S/C17H27NO/c1-4-6-10-14-18(15(3)11-5-2)17(19)16-12-8-7-9-13-16/h7-9,12-13,15H,4-6,10-11,14H2,1-3H3 |
InChIKey |
LNFUFBQWGUWRHD-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
CCCC(N(C(=O)C=1C=CC=CC1)CCCCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870716 |