SpectraBase Spectrum ID |
KfcwSZsRJNl |
Name |
(Z)-Benzyl hepta-4,6-dienylcarbamate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
245.141578854 u |
Formula |
C15H19NO2 |
InChI |
InChI=1S/C15H19NO2/c1-2-3-4-5-9-12-16-15(17)18-13-14-10-7-6-8-11-14/h2-4,6-8,10-11H,1,5,9,12-13H2,(H,16,17)/b4-3- |
InChIKey |
WEDURKWKTVHOTN-ARJAWSKDSA-N |
Molecular Weight |
245.322 g/mol |
SMILES |
C=1(C=CC=CC1)COC(NCCC\C=C/C=C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931215 |