SpectraBase Spectrum ID |
EkQDcEjSlIz |
Name |
Valeramide, 2-methyl-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 |
255.256214686 u |
Formula |
C16H33NO |
InChI |
InChI=1S/C16H33NO/c1-7-9-14(5)16(18)17(12-11-13(3)4)15(6)10-8-2/h13-15H,7-12H2,1-6H3 |
InChIKey |
CIIHTWLJJSEKMK-UHFFFAOYSA-N |
Molecular Weight |
255.446 g/mol |
SMILES |
C(N(CCC(C)C)C(CCC)C)(=O)C(CCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884301 |