SpectraBase Spectrum ID |
GH1k7C8p2sv |
Name |
Acetamide, N-(1-butyl-2-hexenyl)-, (E)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
197.177964364 u |
Formula |
C12H23NO |
InChI |
InChI=1S/C12H23NO/c1-4-6-8-10-12(9-7-5-2)13-11(3)14/h8,10,12H,4-7,9H2,1-3H3,(H,13,14)/b10-8+ |
InChIKey |
VUMZICPRIIMSBM-CSKARUKUSA-N |
Molecular Weight |
197.322 g/mol |
SMILES |
C(NC(\C=C\CCC)CCCC)(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961312 |