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ETHYL-3-[4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-[2,3-D2]-PROPANOATE
SpectraBase Compound ID GEptpZV5NmU
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/i5D,8D
InChIKey UILRWRVJPCXDMB-VBCVTXNDSA-N
Mol Weight 288.27 g/mol
Molecular Formula C13H112H2F3N2O2
Exact Mass 288.105466 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Z6ghMDid0V
Name ETHYL-3-[4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-[2,3-D2]-PROPANOATE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H112H2F3N2O2
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/i5D,8D
InChIKey UILRWRVJPCXDMB-VBCVTXNDSA-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 UWLU56624