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5-CHLORO-2,2-DIFLUORO-5-METHYL-1-PHENYLHEX-3-EN-1-ONE

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5-CHLORO-2,2-DIFLUORO-5-METHYL-1-PHENYLHEX-3-EN-1-ONE
SpectraBase Compound ID 5iMFm6X4Pv3
InChI InChI=1S/C13H13ClF2O/c1-12(2,14)8-9-13(15,16)11(17)10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKey QCANTOHNQAOSIE-CMDGGOBGSA-N
Mol Weight 258.7 g/mol
Molecular Formula C13H13ClF2O
Exact Mass 258.062299 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BFaSb5bN2ee
Name 5-CHLORO-2,2-DIFLUORO-5-METHYL-1-PHENYLHEX-3-EN-1-ONE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13ClF2O
InChI InChI=1S/C13H13ClF2O/c1-12(2,14)8-9-13(15,16)11(17)10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKey QCANTOHNQAOSIE-CMDGGOBGSA-N
Literature Reference Author O.LEFEBVRE,T.BRIGAUD,C.PORTELLA
Literature Reference Citation J.ORG.CHEM.,66,1941(2001)
Literature Reference DOI 10.1021/jo001549j
Solvent Unknown
Source File Reference UWLU26161