| SpectraBase Spectrum ID |
4EUnOMgF9t3 |
| Name |
Benzamide, 3-methyl-N-propyl-N-(3-methylbutyl)- |
| 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/c1-5-10-17(11-9-13(2)3)16(18)15-8-6-7-14(4)12-15/h6-8,12-13H,5,9-11H2,1-4H3 |
| InChIKey |
DIKKEXCQRPQYHO-UHFFFAOYSA-N |
| Molecular Weight |
247.382 g/mol |
| SMILES |
C(C1=CC=CC(C)=C1)(N(CCC(C)C)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953851 |
