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(E)-2,2-Dimethyl-7-phenyl-5-phenylthiomethyl-6-hepten-3-one
SpectraBase Compound ID BkvA4GC3UOd
InChI InChI=1S/C22H26OS/c1-22(2,3)21(23)16-19(15-14-18-10-6-4-7-11-18)17-24-20-12-8-5-9-13-20/h4-15,19H,16-17H2,1-3H3/b15-14+
InChIKey USEJDQZGDLNKND-CCEZHUSRSA-N
Mol Weight 338.51 g/mol
Molecular Formula C22H26OS
Exact Mass 338.170437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Yu7GuEZU9j
Name (E)-2,2-Dimethyl-7-phenyl-5-phenylthiomethyl-6-hepten-3-one
Alternate Name(s) (6E)-2,2-dimethyl-7-phenyl-5-[(phenylsulfanyl)methyl]-6-hepten-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26OS
InChI InChI=1S/C22H26OS/c1-22(2,3)21(23)16-19(15-14-18-10-6-4-7-11-18)17-24-20-12-8-5-9-13-20/h4-15,19H,16-17H2,1-3H3/b15-14+
InChIKey USEJDQZGDLNKND-CCEZHUSRSA-N
Molecular Weight 338.509 g/mol
SMILES C(C(C)(C)C)(CC(\C=C\c1ccccc1)CSc1ccccc1)=O
SPLASH splash10-0a6r-9810000000-5d8188b656f12b865fbc
Source of Spectrum AJ-66-855-13
Wiley ID 771884