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(E)-4,4,4-trifluoro-2-(p-tolylthio)but-2-en-1-yl acetate
SpectraBase Compound ID Fcay48fA0BC
InChI InChI=1S/C13H13F3O2S/c1-9-3-5-11(6-4-9)19-12(7-13(14,15)16)8-18-10(2)17/h3-7H,8H2,1-2H3/b12-7+
InChIKey FWJLSPCYMNMCCB-KPKJPENVSA-N
Mol Weight 290.3 g/mol
Molecular Formula C13H13F3O2S
Exact Mass 290.058835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zeUywppwla
Name (E)-4,4,4-trifluoro-2-(p-tolylthio)but-2-en-1-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3O2S
InChI InChI=1S/C13H13F3O2S/c1-9-3-5-11(6-4-9)19-12(7-13(14,15)16)8-18-10(2)17/h3-7H,8H2,1-2H3/b12-7+
InChIKey FWJLSPCYMNMCCB-KPKJPENVSA-N
Molecular Weight 290.300 g/mol
SMILES C(\C=C/(Sc1ccc(cc1)C)COC(=O)C)(F)(F)F
SPLASH splash10-006x-9610000000-e4651d68f73fc43fd34b
Source of Spectrum F-65-2762-12
Wiley ID 1681248