SpectraBase Spectrum ID |
31TqTnrIFwB |
Name |
1-(2-Cyclohexenyl)-2-(1-cyclohexenyl)ethanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.151415263 u |
Formula |
C14H20O |
InChI |
InChI=1S/C14H20O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h5,7,9,13H,1-4,6,8,10-11H2 |
InChIKey |
CSDXLZBQAJLRHL-UHFFFAOYSA-N |
Molecular Weight |
204.313 g/mol |
SMILES |
C(CC1=CCCCC1)(=O)C1C=CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983271 |