SpectraBase Spectrum ID |
CGtC8EiZJo3 |
Name |
Isobutyramide, N-(2-butyl)-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
213.209264492 u |
Formula |
C13H27NO |
InChI |
InChI=1S/C13H27NO/c1-7-12(6)14(9-8-10(2)3)13(15)11(4)5/h10-12H,7-9H2,1-6H3 |
InChIKey |
KGIHDDRQJQZIMG-UHFFFAOYSA-N |
Molecular Weight |
213.365 g/mol |
SMILES |
C(=O)(N(CCC(C)C)C(CC)C)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964644 |