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(2S)-6-Methyl-1,1-difluoro-3-[(4'-methylphenyl)sulfinyl]hept-5-en-2-ol
SpectraBase Compound ID 8thoQF9to5Y
InChI InChI=1S/C15H20F2O2S/c1-10(2)4-9-13(14(18)15(16)17)20(19)12-7-5-11(3)6-8-12/h4-8,13-15,18H,9H2,1-3H3/t13?,14-,20?/m1/s1
InChIKey CJNGSJVCLSPECB-LQZXRHCMSA-N
Mol Weight 302.38 g/mol
Molecular Formula C15H20F2O2S
Exact Mass 302.115207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnCx6nMT6CH
Name (2S)-6-Methyl-1,1-difluoro-3-[(4'-methylphenyl)sulfinyl]hept-5-en-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20F2O2S
InChI InChI=1S/C15H20F2O2S/c1-10(2)4-9-13(14(18)15(16)17)20(19)12-7-5-11(3)6-8-12/h4-8,13-15,18H,9H2,1-3H3/t13?,14-,20?/m1/s1
InChIKey CJNGSJVCLSPECB-LQZXRHCMSA-N
Molecular Weight 302.380 g/mol
SMILES O[C@](C(S(c1ccc(cc1)C)=O)CC=C(C)C)(C(F)F)[H]
SPLASH splash10-0udl-9407000000-5411ca40fcc61f55298a
Source of Spectrum U1-1999-121-2
Synonyms (2S)-1,1-difluoro-6-methyl-3-[(4-methylphenyl)sulfinyl]-5-hepten-2-ol
Wiley ID 752267