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(4S,5S)-4-(p-tolylsulfanyl)-5-(trifluoromethyl)tetrahydrofuran-2-one
SpectraBase Compound ID 4SVLfzRbPmb
InChI InChI=1S/C12H11F3O2S/c1-7-2-4-8(5-3-7)18-9-6-10(16)17-11(9)12(13,14)15/h2-5,9,11H,6H2,1H3/t9-,11+/m0/s1
InChIKey WQKKYWCEVHFPEL-GXSJLCMTSA-N
Mol Weight 276.27 g/mol
Molecular Formula C12H11F3O2S
Exact Mass 276.043185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl2AueLRdyi
Name (4S,5S)-4-(p-tolylsulfanyl)-5-(trifluoromethyl)tetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11F3O2S
InChI InChI=1S/C12H11F3O2S/c1-7-2-4-8(5-3-7)18-9-6-10(16)17-11(9)12(13,14)15/h2-5,9,11H,6H2,1H3/t9-,11+/m0/s1
InChIKey WQKKYWCEVHFPEL-GXSJLCMTSA-N
Molecular Weight 276.273 g/mol
SMILES [C@@]1(C(F)(F)F)([C@](CC(O1)=O)(Sc1ccc(cc1)C)[H])[H]
SPLASH splash10-004i-0390000000-8323eac55e1e90bbf695
Source of Spectrum K1-2002-1899-7
Synonyms (4S,5S)-4-(p-tolylthio)-5-(trifluoromethyl)tetrahydrofuran-2-one (4S,5S)-4-[(4-methylphenyl)thio]-5-(trifluoromethyl)-2-oxolanone
Wiley ID 872342