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3-[4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOATE
SpectraBase Compound ID Bzz4FhATIA6
InChI InChI=1S/C13H13F3N2O2/c1-2-20-11(19)8-5-9-3-6-10(7-4-9)12(17-18-12)13(14,15)16/h3-4,6-7H,2,5,8H2,1H3
InChIKey UILRWRVJPCXDMB-UHFFFAOYSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H13F3N2O2
Exact Mass 286.092912 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QKSGIt8D3w
Name 3-[4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOATE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13F3N2O2
InChI InChI=1S/C13H13F3N2O2/c1-2-20-11(19)8-5-9-3-6-10(7-4-9)12(17-18-12)13(14,15)16/h3-4,6-7H,2,5,8H2,1H3
InChIKey UILRWRVJPCXDMB-UHFFFAOYSA-N
Literature Reference Author M.HASHIMOTO,Y.H.KATO,Y.HATANAKA
Literature Reference Citation CHEM.PHARM.BULL.,55,1540(2007)
Literature Reference DOI 10.1248/cpb.55.1540
Solvent CDCl3
Source File Reference UWLU56614