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1,2-Difluoro-1-(phenylthio)cyclohexane isomer
SpectraBase Compound ID 9DxNfoyxk9d
InChI InChI=1S/C12H14F2S/c13-11-8-4-5-9-12(11,14)15-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKey LYWOURJSDYDWOE-UHFFFAOYSA-N
Mol Weight 228.3 g/mol
Molecular Formula C12H14F2S
Exact Mass 228.078428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTnp6diwuwz
Name 1,2-Difluoro-1-(phenylthio)cyclohexane isomer
Alternate Name(s) 1,2-Difluoro-1-(phenylthio)cyclohexane 1,2-Difluorocyclohexyl phenyl sulfide [(1,2-Difluorocyclohexyl)sulfanyl]benzene
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Formula C12H14F2S
InChI InChI=1S/C12H14F2S/c13-11-8-4-5-9-12(11,14)15-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKey LYWOURJSDYDWOE-UHFFFAOYSA-N
Molecular Weight 228.301 g/mol
SMILES C1(Sc2ccccc2)(C(F)CCCC1)F
SPLASH splash10-004r-9800000000-15dbd443465e8378e464
Source of Spectrum F-51-2616-6
Wiley ID 791214