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2-(4-Methoxyphenyl)-2-methyl-1-cyclohexanone

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

2-(4-Methoxyphenyl)-2-methyl-1-cyclohexanone
SpectraBase Compound ID 9Oltc0KsXSq
InChI InChI=1S/C14H18O2/c1-14(10-4-3-5-13(14)15)11-6-8-12(16-2)9-7-11/h6-9H,3-5,10H2,1-2H3
InChIKey PPURKAMLZDCZHH-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3dZwgpZufGH
Name 2-(4-Methoxyphenyl)-2-methyl-1-cyclohexanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.130679818 u
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-14(10-4-3-5-13(14)15)11-6-8-12(16-2)9-7-11/h6-9H,3-5,10H2,1-2H3
InChIKey PPURKAMLZDCZHH-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES C1(C(=O)CCCC1)(C=1C=CC(=CC1)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959703