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9-methyl-1,3,7-triphenyl-undecane-1,5-dione
SpectraBase Compound ID 1a4JOCV1mGW
InChI InChI=1S/C30H34O2/c1-3-23(2)19-27(24-13-7-4-8-14-24)20-29(31)21-28(25-15-9-5-10-16-25)22-30(32)26-17-11-6-12-18-26/h4-18,23,27-28H,3,19-22H2,1-2H3
InChIKey WTFPUUMYNZCXTK-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C30H34O2
Exact Mass 426.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WvWNG79IO
Name 9-methyl-1,3,7-triphenyl-undecane-1,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H34O2
InChI InChI=1S/C30H34O2/c1-3-23(2)19-27(24-13-7-4-8-14-24)20-29(31)21-28(25-15-9-5-10-16-25)22-30(32)26-17-11-6-12-18-26/h4-18,23,27-28H,3,19-22H2,1-2H3
InChIKey WTFPUUMYNZCXTK-UHFFFAOYSA-N
Instrument Name Agilent Model 7820A-5977B
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202102317
Molecular Weight 426.600 g/mol
SMILES c1cc(ccc1)C(=O)CC(CC(=O)CC(c1ccccc1)CC(CC)C)c1ccccc1
SPLASH splash10-0006-3920000000-9da7d35a21636cf1a616
Source of Spectrum CSC-15-SM54-Figure S47-h
Wiley ID 1873434