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1,1,1-Trifluoro-4-(4-fluorophenyl)-4-mercapto-3-buten-2-one
SpectraBase Compound ID 6hfaFtKqI9i
InChI InChI=1S/C10H6F4OS/c11-7-3-1-6(2-4-7)8(16)5-9(15)10(12,13)14/h1-5,16H/b8-5-
InChIKey VWQWMNQXJIJYES-YVMONPNESA-N
Mol Weight 250.21 g/mol
Molecular Formula C10H6F4OS
Exact Mass 250.007549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXvHmhdoEY9
Name 1,1,1-Trifluoro-4-(4-fluorophenyl)-4-mercapto-3-buten-2-one
CAS Registry Number 55674-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6F4OS
InChI InChI=1S/C10H6F4OS/c11-7-3-1-6(2-4-7)8(16)5-9(15)10(12,13)14/h1-5,16H/b8-5-
InChIKey VWQWMNQXJIJYES-YVMONPNESA-N
Molecular Weight 250.211 g/mol
SMILES S\C(=C/C(C(F)(F)F)=O)c1ccc(cc1)F
SPLASH splash10-0f8i-1920000000-82245a58b246617c74f6
Source of Spectrum W5-21869-0-0
Synonyms (Z)-1,1,1-trifluoro-4-(4-fluorophenyl)-4-mercapto-3-buten-2-one (Z)-1,1,1-trifluoro-4-(4-fluorophenyl)-4-sulfanylbut-3-en-2-one (Z)-1,1,1-trifluoro-4-(4-fluorophenyl)-4-sulfanyl-but-3-en-2-one (Z)-1,1,1-tris(fluoranyl)-4-(4-fluorophenyl)-4-sulfanyl-but-3-en-2-one
Wiley ID 1252650