SpectraBase Spectrum ID |
ASJvQcu3r9e |
Name |
(E,Z)-N,3,7-Trimethyl-2,6-octadienamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
181.146664235 u |
Formula |
C11H19NO |
InChI |
InChI=1S/C11H19NO/c1-9(2)6-5-7-10(3)8-11(13)12-4/h6,8H,5,7H2,1-4H3,(H,12,13)/b10-8+ |
InChIKey |
ZKQQGBOHAGHVLW-CSKARUKUSA-N |
Molecular Weight |
181.279 g/mol |
SMILES |
C(\C=C\(CCC=C(C)C)C)(=O)NC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987015 |