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2,2-DIFLUORO-2-(2-METHYLPHENYL)-ACETONITRILE

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2,2-DIFLUORO-2-(2-METHYLPHENYL)-ACETONITRILE
SpectraBase Compound ID 6iYC3lvxwvb
InChI InChI=1S/C9H7F2N/c1-7-4-2-3-5-8(7)9(10,11)6-12/h2-5H,1H3
InChIKey ZLQXACQSGYGTSG-UHFFFAOYSA-N
Mol Weight 167.16 g/mol
Molecular Formula C9H7F2N
Exact Mass 167.054656 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xJIF1IzoAC
Name 2,2-DIFLUORO-2-(2-METHYLPHENYL)-ACETONITRILE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7F2N
InChI InChI=1S/C9H7F2N/c1-7-4-2-3-5-8(7)9(10,11)6-12/h2-5H,1H3
InChIKey ZLQXACQSGYGTSG-UHFFFAOYSA-N
Literature Reference Author C.C.KOTORIS,M.J.CHEN,S.D.TAYLOR
Literature Reference Citation J.ORG.CHEM.,63,8052(1998)
Literature Reference DOI 10.1021/jo981163x
Solvent CDCl3
Source File Reference UWMZ26501