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rac-(1S,6R)-7,7-Difluoro-1-phenylbicyclo[4.1.0]heptane
SpectraBase Compound ID 93bky2ETekC
InChI InChI=1S/C13H14F2/c14-13(15)11-8-4-5-9-12(11,13)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2/t11-,12-/m1/s1
InChIKey FTKDGROQWHTWOM-VXGBXAGGSA-N
Mol Weight 208.25 g/mol
Molecular Formula C13H14F2
Exact Mass 208.106357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yNe70cfeUi
Name rac-(1S,6R)-7,7-Difluoro-1-phenylbicyclo[4.1.0]heptane
Alternate Name(s) (1R,6S)-7,7-difluoro-6-phenylbicyclo[4.1.0]heptane (1R,6S)-7,7-bis(fluoranyl)-6-phenyl-bicyclo[4.1.0]heptane
Comments Less than 3 mono-isotopic peaks
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Formula C13H14F2
InChI InChI=1S/C13H14F2/c14-13(15)11-8-4-5-9-12(11,13)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2/t11-,12-/m1/s1
InChIKey FTKDGROQWHTWOM-VXGBXAGGSA-N
Molecular Weight 208.252 g/mol
SMILES C1([C@@]2(c3ccccc3)CCCC[C@@]12[H])(F)F
SPLASH splash10-0a4i-1090000000-077e25d39fda66fafa77
Source of Spectrum F4-42-2082-2e
Wiley ID 1674166