SpectraBase Spectrum ID |
1LZMqafOSGd |
Name |
Isobutyramide, N-(2-pentyl)-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
227.224914557 u |
Formula |
C14H29NO |
InChI |
InChI=1S/C14H29NO/c1-7-8-13(6)15(10-9-11(2)3)14(16)12(4)5/h11-13H,7-10H2,1-6H3 |
InChIKey |
WKPBWEDMHLSAHH-UHFFFAOYSA-N |
Molecular Weight |
227.392 g/mol |
SMILES |
C(N(CCC(C)C)C(CCC)C)(=O)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959315 |