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4-(4-Methoxyphenyl)-4-phenyl-butan-2-one

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

4-(4-Methoxyphenyl)-4-phenyl-butan-2-one
SpectraBase Compound ID 5YQjt95jXHM
InChI InChI=1S/C17H18O2/c1-13(18)12-17(14-6-4-3-5-7-14)15-8-10-16(19-2)11-9-15/h3-11,17H,12H2,1-2H3
InChIKey RMOFTLRWMNWHJR-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EA28Jjlrykb
Name 4-(4-Methoxyphenyl)-4-phenyl-2-butanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.130679818 u
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-13(18)12-17(14-6-4-3-5-7-14)15-8-10-16(19-2)11-9-15/h3-11,17H,12H2,1-2H3
InChIKey RMOFTLRWMNWHJR-UHFFFAOYSA-N
Molecular Weight 254.329 g/mol
SMILES C(C=1C=CC(=CC1)OC)(CC(=O)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951892