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1-(2-Cyclohexenyl)-2-(1-cyclohexenyl)ethanone
SpectraBase Compound ID CA4g9wO4MsQ
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
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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