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3-Buten-2-one, 1-(4-tert-butyl-2,6-xylyl)-3-phenyl-
SpectraBase Compound ID 1YuUlLc1RfJ
InChI InChI=1S/C22H26O/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/h7-13H,3,14H2,1-2,4-6H3
InChIKey RERBFCVZQFXATA-UHFFFAOYSA-N
Mol Weight 306.45 g/mol
Molecular Formula C22H26O
Exact Mass 306.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WyY3vSu0CZ
Name 3-Buten-2-one, 1-(4-tert-butyl-2,6-xylyl)-3-phenyl-
CAS Registry Number 29906-96-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O
InChI InChI=1S/C22H26O/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/h7-13H,3,14H2,1-2,4-6H3
InChIKey RERBFCVZQFXATA-UHFFFAOYSA-N
Molecular Weight 306.449 g/mol
SMILES Cc1cc(cc(C)c1CC(C(=C)c1ccccc1)=O)C(C)(C)C
SPLASH splash10-004i-1901000000-58debc6151cb2c79285c
Source of Spectrum KG-100-515-21
Synonyms 1-(4-tert-Butyl-2,6-dimethylphenyl)-3-phenyl-3-buten-2-one 1-(4-tert-butyl-2,6-dimethyl-phenyl)-3-phenyl-but-3-en-2-one
Wiley ID 1308670