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2-Butanone, 1-(4-tert-butyl-2,6-xylyl)-3-o-tolyl-
SpectraBase Compound ID 1glo5IE4huL
InChI InChI=1S/C23H30O/c1-15-10-8-9-11-20(15)18(4)22(24)14-21-16(2)12-19(13-17(21)3)23(5,6)7/h8-13,18H,14H2,1-7H3
InChIKey YLZWRPSUFHRHKY-UHFFFAOYSA-N
Mol Weight 322.49 g/mol
Molecular Formula C23H30O
Exact Mass 322.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Gq7yi2LP8i
Name 2-Butanone, 1-(4-tert-butyl-2,6-xylyl)-3-o-tolyl-
CAS Registry Number 29549-26-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O
InChI InChI=1S/C23H30O/c1-15-10-8-9-11-20(15)18(4)22(24)14-21-16(2)12-19(13-17(21)3)23(5,6)7/h8-13,18H,14H2,1-7H3
InChIKey YLZWRPSUFHRHKY-UHFFFAOYSA-N
Molecular Weight 322.492 g/mol
SMILES Cc1ccccc1C(C)C(Cc1c(C)cc(cc1C)C(C)(C)C)=O
SPLASH splash10-004i-1900000000-bab1b4df632a7f43a63c
Source of Spectrum KG-100-518-30
Synonyms 1-(4-tert-Butyl-2,6-dimethylphenyl)-3-(2-methylphenyl)-2-butanone 1-(4-tert-butyl-2,6-dimethyl-phenyl)-3-(2-methylphenyl)butan-2-one 1-(4-tert-butyl-2,6-dimethyl-phenyl)-3-(o-tolyl)butan-2-one
Wiley ID 1322191