SpectraBase Spectrum ID |
9Sunxojk70f |
Name |
Benzamide, 2-methyl-N-(2-pentyl)-N-butyl- |
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/c1-5-7-13-18(15(4)10-6-2)17(19)16-12-9-8-11-14(16)3/h8-9,11-12,15H,5-7,10,13H2,1-4H3 |
InChIKey |
IMBQMJCCLZVYGM-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C(N(CCCC)C(CCC)C)(=O)C=1C(=CC=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95064 |