SpectraBase Spectrum ID |
DJN3b8NIgkr |
Name |
Benzamide, 2-methyl-N-butyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
247.193614428 u |
Formula |
C16H25NO |
InChI |
InChI=1S/C16H25NO/c1-5-6-11-17(12-13(2)3)16(18)15-10-8-7-9-14(15)4/h7-10,13H,5-6,11-12H2,1-4H3 |
InChIKey |
NZLRCQDTARKGRB-UHFFFAOYSA-N |
Molecular Weight |
247.382 g/mol |
SMILES |
C1=CC=C(C(=C1)C)C(N(CC(C)C)CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917116 |