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4,4,4-TRIFLUORO-3-HYDROXY-3-PHENYL-2-METHYLENEBUTYRONITRILE

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4,4,4-TRIFLUORO-3-HYDROXY-3-PHENYL-2-METHYLENEBUTYRONITRILE
SpectraBase Compound ID HSaRGl5BScq
InChI InChI=1S/C11H8F3NO/c1-8(7-15)10(16,11(12,13)14)9-5-3-2-4-6-9/h2-6,16H,1H2
InChIKey AKMGEAPAYHFNLS-UHFFFAOYSA-N
Mol Weight 227.19 g/mol
Molecular Formula C11H8F3NO
Exact Mass 227.055798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86sv5BTtEAe
Name 4,4,4-TRIFLUORO-3-HYDROXY-3-PHENYL-2-METHYLENEBUTYRONITRILE
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H8F3NO
InChI InChI=1S/C11H8F3NO/c1-8(7-15)10(16,11(12,13)14)9-5-3-2-4-6-9/h2-6,16H,1H2
InChIKey AKMGEAPAYHFNLS-UHFFFAOYSA-N
Literature Reference Author M.V.R.REDDY,M.T.RUDD,P.V.RAMACHANDRAN
Literature Reference Citation J.ORG.CHEM.,67,5382(2002)
Literature Reference DOI 10.1021/jo025591l
Molecular Weight 227.186 g/mol
Solvent CDCl3
Source File Reference UWVN23418