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2-Methyl-4(1-oxo-propyl)-3,5-diphenyl-cyclohexanone
SpectraBase Compound ID FmHo2YrDNGd
InChI InChI=1S/C22H24O2/c1-3-19(23)22-18(16-10-6-4-7-11-16)14-20(24)15(2)21(22)17-12-8-5-9-13-17/h4-13,15,18,21-22H,3,14H2,1-2H3
InChIKey BLBMUBMXUQBREC-UHFFFAOYSA-N
Mol Weight 320.43 g/mol
Molecular Formula C22H24O2
Exact Mass 320.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YKXoJxV7Fw
Name 2-Methyl-4(1-oxo-propyl)-3,5-diphenyl-cyclohexanone
Alternate Name(s) 2-Methyl-3,5-diphenyl-4-propionylcyclohexanone
CAS Registry Number 104531-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O2
InChI InChI=1S/C22H24O2/c1-3-19(23)22-18(16-10-6-4-7-11-16)14-20(24)15(2)21(22)17-12-8-5-9-13-17/h4-13,15,18,21-22H,3,14H2,1-2H3
InChIKey BLBMUBMXUQBREC-UHFFFAOYSA-N
Molecular Weight 320.432 g/mol
SMILES C1(C(CC(C(C1c1ccccc1)C)=O)c1ccccc1)C(=O)CC
SPLASH splash10-0zfu-9080000000-32aa7ea2e9eeb7278127
Source of Spectrum F-41-5682-2
Wiley ID 1320621