SpectraBase Spectrum ID |
1vKn65t1SQ7 |
Name |
Benzamide, 3-methyl-N-methyl-N-(2-ethylhexyl)- |
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/c1-5-7-10-15(6-2)13-18(4)17(19)16-11-8-9-14(3)12-16/h8-9,11-12,15H,5-7,10,13H2,1-4H3 |
InChIKey |
SPPWBRGWSBKHSH-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C(=O)(N(CC(CCCC)CC)C)C=1C=CC=C(C)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959696 |