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1-Methyl-2-((phenylcarbonyl)methyl)-1-cyclohexene

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

1-Methyl-2-((phenylcarbonyl)methyl)-1-cyclohexene
SpectraBase Compound ID KApPzbGn0xC
InChI InChI=1S/C15H18O/c1-12-7-5-6-10-14(12)11-15(16)13-8-3-2-4-9-13/h2-4,8-9H,5-7,10-11H2,1H3
InChIKey AIWXWGBTSURNEG-UHFFFAOYSA-N
Mol Weight 214.31 g/mol
Molecular Formula C15H18O
Exact Mass 214.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B5WLR1Jn38C
Name 1-Methyl-2-((phenylcarbonyl)methyl)-1-cyclohexene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.135765199 u
Formula C15H18O
InChI InChI=1S/C15H18O/c1-12-7-5-6-10-14(12)11-15(16)13-8-3-2-4-9-13/h2-4,8-9H,5-7,10-11H2,1H3
InChIKey AIWXWGBTSURNEG-UHFFFAOYSA-N
Molecular Weight 214.308 g/mol
SMILES C1(=C(CCCC1)CC(=O)C=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.972312