| SpectraBase Spectrum ID |
t5S4bBdixN |
| Name |
(Z)-1-Ethoxycarbonyl-1-(1-cyclohexenyl)-1-hexene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-3-5-7-12-14(15(16)17-4-2)13-10-8-6-9-11-13/h10,12H,3-9,11H2,1-2H3/b14-12- |
| InChIKey |
JKPKKCQEDCGFPW-OWBHPGMISA-N |
| Molecular Weight |
236.355 g/mol |
| SMILES |
C(\C=C\(C1=CCCCC1)C(=O)OCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97761 |
