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(2RS,3SR)-3-Acetoxy-2-p-tolylsulfanyl-2-trifluoromethyl-3,6-dihydro-2H-thiopyran
SpectraBase Compound ID IwU46t32wS3
InChI InChI=1S/C15H15F3O2S2/c1-10-5-7-12(8-6-10)22-14(15(16,17)18)13(20-11(2)19)4-3-9-21-14/h3-8,13H,9H2,1-2H3/t13-,14-/m0/s1
InChIKey VASLXZLFDSYPHK-KBPBESRZSA-N
Mol Weight 348.4 g/mol
Molecular Formula C15H15F3O2S2
Exact Mass 348.046557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qSmtUYgfah
Name (2RS,3SR)-3-Acetoxy-2-p-tolylsulfanyl-2-trifluoromethyl-3,6-dihydro-2H-thiopyran
Appearance Pale yellow oil
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Formula C15H15F3O2S2
InChI InChI=1S/C15H15F3O2S2/c1-10-5-7-12(8-6-10)22-14(15(16,17)18)13(20-11(2)19)4-3-9-21-14/h3-8,13H,9H2,1-2H3/t13-,14-/m0/s1
InChIKey VASLXZLFDSYPHK-KBPBESRZSA-N
Instrument Name Hewlett-Packard 5890/5972
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800643
Molecular Weight 348.398 g/mol
Quality 205
SMILES [C@]1(C=CCS[C@]1(C(F)(F)F)SC1=CC=C(C=C1)C)(OC(C)=O)[H]
SPLASH splash10-002f-9450000000-ee4a58c84749c1846f69
Source of Spectrum K1-2018-5579-2a (DOI: 10.1002/ejoc.201800643)
Wiley ID 1894348