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8-Phenyl-4-cycloocten-1-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

8-Phenyl-4-cycloocten-1-one
SpectraBase Compound ID IRXfWMZY4of
InChI InChI=1S/C14H16O/c15-14-11-7-2-1-6-10-13(14)12-8-4-3-5-9-12/h1-5,8-9,13H,6-7,10-11H2/b2-1-
InChIKey KFVXTRBIQDACMN-UPHRSURJSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HWcAMEAxRvT
Name (+-)-8-phenyl-4-cycloocten-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.120115134 u
Formula C14H16O
InChI InChI=1S/C14H16O/c15-14-11-7-2-1-6-10-13(14)12-8-4-3-5-9-12/h1-5,8-9,13H,6-7,10-11H2/b2-1-
InChIKey KFVXTRBIQDACMN-UPHRSURJSA-N
Molecular Weight 200.281 g/mol
SMILES C1(C(C=2C=CC=CC2)CC\C=C/CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933385