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(2RS,4SR)-4-Acetoxy-2-trifluoromethyl-3,4-dihydro-2''-thiopyran
SpectraBase Compound ID BaWzPgMNjeJ
InChI InChI=1S/C8H9F3O2S/c1-5(12)13-6-2-3-14-7(4-6)8(9,10)11/h2-3,6-7H,4H2,1H3/t6-,7-/m1/s1
InChIKey CJISGYJMDYPHGQ-RNFRBKRXSA-N
Mol Weight 226.21 g/mol
Molecular Formula C8H9F3O2S
Exact Mass 226.027535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lxdfQcjJ0
Name (2RS,4SR)-4-Acetoxy-2-trifluoromethyl-3,4-dihydro-2''-thiopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9F3O2S
InChI InChI=1S/C8H9F3O2S/c1-5(12)13-6-2-3-14-7(4-6)8(9,10)11/h2-3,6-7H,4H2,1H3/t6-,7-/m1/s1
InChIKey CJISGYJMDYPHGQ-RNFRBKRXSA-N
Molecular Weight 226.213 g/mol
SMILES C([C@@]1(SC=C[C@](C1)(OC(=O)C)[H])[H])(F)(F)F
SPLASH splash10-00kb-9700000000-ff1181746b2c49ab2dc5
Source of Spectrum HC-50-475-7b
Synonyms (2RS,4SR)-4-Acetoxy-2-trifluoromethyl-3,4-dihydro-2H-thiopyran (2R,4S)-2-(trifluoromethyl)-3,4-dihydro-2H-thiopyran-4-yl acetate
Wiley ID 1739703