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5-methyl-1,3-diphenyl-heptan-1-one
SpectraBase Compound ID E9BmQI53VYm
InChI InChI=1S/C20H24O/c1-3-16(2)14-19(17-10-6-4-7-11-17)15-20(21)18-12-8-5-9-13-18/h4-13,16,19H,3,14-15H2,1-2H3
InChIKey QNHVIRSJMWLAGI-UHFFFAOYSA-N
Mol Weight 280.41 g/mol
Molecular Formula C20H24O
Exact Mass 280.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUyCtymL4iP
Name 5-methyl-1,3-diphenyl-heptan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O
InChI InChI=1S/C20H24O/c1-3-16(2)14-19(17-10-6-4-7-11-17)15-20(21)18-12-8-5-9-13-18/h4-13,16,19H,3,14-15H2,1-2H3
InChIKey QNHVIRSJMWLAGI-UHFFFAOYSA-N
Instrument Name Agilent Model 7820A-5977B
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202102317
Molecular Weight 280.411 g/mol
SMILES c1cc(ccc1)C(=O)CC(c1ccccc1)CC(C)CC
SPLASH splash10-0006-9700000000-86991f5d7b5bdc685c56
Source of Spectrum CSC-15-SM54-Figure S47-d
Wiley ID 1873431