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(E)-1,1,1-Trifluoro-4-(thiophen-2-yl)but-3-en-2-ol
SpectraBase Compound ID Iqi72BjNxBt
InChI InChI=1S/C8H7F3OS/c9-8(10,11)7(12)4-3-6-2-1-5-13-6/h1-5,7,12H/b4-3+
InChIKey BDRWNTHDAWTQJP-ONEGZZNKSA-N
Mol Weight 208.2 g/mol
Molecular Formula C8H7F3OS
Exact Mass 208.016971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10zCrADhKdP
Name (E)-1,1,1-Trifluoro-4-(thiophen-2-yl)but-3-en-2-ol
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.016970507 u
Formula C8H7F3OS
InChI InChI=1S/C8H7F3OS/c9-8(10,11)7(12)4-3-6-2-1-5-13-6/h1-5,7,12H/b4-3+
InChIKey BDRWNTHDAWTQJP-ONEGZZNKSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804614
Molecular Weight 208.198 g/mol
Quality 418
SMILES OC(\C=C\C1=CC=CS1)C(F)(F)F
SPLASH splash10-0a4r-9620000000-b13b20d5e47f61a9e1be
Source of Spectrum ACI-57-SM27-SI-5f (DOI: 10.1002/anie.201804614)
Thin-Layer Chromatography 0.40 (petroleum ether/EtOAc, 9:1)
Wiley ID 1893074