| SpectraBase Spectrum ID |
FMpU638bGQ5 |
| Name |
Benzamide, 3-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/c1-5-6-10-17(12-13(2)3)16(18)15-9-7-8-14(4)11-15/h7-9,11,13H,5-6,10,12H2,1-4H3 |
| InChIKey |
YSNPPBJEYZUZLY-UHFFFAOYSA-N |
| Molecular Weight |
247.382 g/mol |
| SMILES |
C1=CC=C(C=C1C)C(N(CC(C)C)CCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937563 |
