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(2RS,4RS)-4-Hydroxy-2-(p-tolylsulfanyl)-2-trifluoromethyl-3,4-dihydro-2''-thiopyran
SpectraBase Compound ID DwbroEde5iB
InChI InChI=1S/C13H13F3OS2/c1-9-2-4-11(5-3-9)19-12(13(14,15)16)8-10(17)6-7-18-12/h2-7,10,17H,8H2,1H3/t10-,12-/m0/s1
InChIKey ZXJRZTZZPKCQOA-JQWIXIFHSA-N
Mol Weight 306.36 g/mol
Molecular Formula C13H13F3OS2
Exact Mass 306.035992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFylDSckzVF
Name (2RS,4RS)-4-Hydroxy-2-(p-tolylsulfanyl)-2-trifluoromethyl-3,4-dihydro-2''-thiopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3OS2
InChI InChI=1S/C13H13F3OS2/c1-9-2-4-11(5-3-9)19-12(13(14,15)16)8-10(17)6-7-18-12/h2-7,10,17H,8H2,1H3/t10-,12-/m0/s1
InChIKey ZXJRZTZZPKCQOA-JQWIXIFHSA-N
Molecular Weight 306.361 g/mol
SMILES O[C@]1(C=CS[C@@](C(F)(F)F)(C1)Sc1ccc(C)cc1)[H]
SPLASH splash10-006x-7900000000-c3c553d118097a22500e
Source of Spectrum HC-50-474-5a
Synonyms (2RS,4RS)-4-Hydroxy-2-(p-tolylsulfanyl)-2-trifluoromethyl-3,4-dihydro-2H-thiopyran (2S,4R)-2-(p-tolylthio)-2-(trifluoromethyl)-3,4-dihydro-2H-thiopyran-4-ol
Wiley ID 1739708