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1,1,1-Trifluoro-3-phenyl-2-phenylthio-2-butene
SpectraBase Compound ID J5grBWBfuxl
InChI InChI=1S/C16H13F3S/c1-12(13-8-4-2-5-9-13)15(16(17,18)19)20-14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKey YFLMBLKUIGPOHF-NTCAYCPXSA-N
Mol Weight 294.34 g/mol
Molecular Formula C16H13F3S
Exact Mass 294.069006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4jbf9QaRTl
Name 1,1,1-Trifluoro-3-phenyl-2-phenylthio-2-butene
Alternate Name(s) phenyl (1E)-2-phenyl-1-(trifluoromethyl)-1-propenyl sulfide [(1E)-3,3,3-trifluoro-1-methyl-2-(phenylsulfanyl)-1-propenyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3S
InChI InChI=1S/C16H13F3S/c1-12(13-8-4-2-5-9-13)15(16(17,18)19)20-14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKey YFLMBLKUIGPOHF-NTCAYCPXSA-N
Molecular Weight 294.335 g/mol
SMILES C(\C(=C/(c1ccccc1)C)Sc1ccccc1)(F)(F)F
SPLASH splash10-00mn-2790000000-9cf3e2d5365b2492f914
Source of Spectrum QB-22-354-2
Wiley ID 860668