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2,2-DIFLUORO-2-(3-METHOXYPHENYL)-ACETONITRILE

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2,2-DIFLUORO-2-(3-METHOXYPHENYL)-ACETONITRILE
SpectraBase Compound ID ITETNYqHops
InChI InChI=1S/C9H7F2NO/c1-13-8-4-2-3-7(5-8)9(10,11)6-12/h2-5H,1H3
InChIKey KCOHFNKWZTUHKD-UHFFFAOYSA-N
Mol Weight 183.16 g/mol
Molecular Formula C9H7F2NO
Exact Mass 183.04957 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2PfugTWwska
Name 2,2-DIFLUORO-2-(3-METHOXYPHENYL)-ACETONITRILE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7F2NO
InChI InChI=1S/C9H7F2NO/c1-13-8-4-2-3-7(5-8)9(10,11)6-12/h2-5H,1H3
InChIKey KCOHFNKWZTUHKD-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 UWMZ26506