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2-Butanone, 1-(4-tert-butyl-2,6-xylyl)-3-phenyl-
SpectraBase Compound ID 1mlaVlbwh1T
InChI InChI=1S/C22H28O/c1-15-12-19(22(4,5)6)13-16(2)20(15)14-21(23)17(3)18-10-8-7-9-11-18/h7-13,17H,14H2,1-6H3
InChIKey OOVFRWWFJOSTLC-UHFFFAOYSA-N
Mol Weight 308.47 g/mol
Molecular Formula C22H28O
Exact Mass 308.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpphbVAs76R
Name 2-Butanone, 1-(4-tert-butyl-2,6-xylyl)-3-phenyl-
Alternate Name(s) 1-(4-tert-Butyl-2,6-dimethylphenyl)-3-phenyl-2-butanone 1-(4-tert-butyl-2,6-dimethyl-phenyl)-3-phenyl-butan-2-one
CAS Registry Number 29549-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O
InChI InChI=1S/C22H28O/c1-15-12-19(22(4,5)6)13-16(2)20(15)14-21(23)17(3)18-10-8-7-9-11-18/h7-13,17H,14H2,1-6H3
InChIKey OOVFRWWFJOSTLC-UHFFFAOYSA-N
Molecular Weight 308.465 g/mol
SMILES Cc1cc(cc(C)c1CC(C(C)c1ccccc1)=O)C(C)(C)C
SPLASH splash10-004i-1900000000-1bc478d843ae665822a0
Source of Spectrum KG-100-517-23
Wiley ID 1310375