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3-[2-METHOXY-4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOIC-ACID
SpectraBase Compound ID 1HVFbasj0oZ
InChI InChI=1S/C12H11F3N2O3/c1-20-9-6-8(11(16-17-11)12(13,14)15)4-2-7(9)3-5-10(18)19/h2,4,6H,3,5H2,1H3,(H,18,19)
InChIKey JVIALZQUDQPEND-UHFFFAOYSA-N
Mol Weight 288.23 g/mol
Molecular Formula C12H11F3N2O3
Exact Mass 288.072177 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 952MAtgRQLo
Name 3-[2-METHOXY-4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOIC-ACID
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11F3N2O3
InChI InChI=1S/C12H11F3N2O3/c1-20-9-6-8(11(16-17-11)12(13,14)15)4-2-7(9)3-5-10(18)19/h2,4,6H,3,5H2,1H3,(H,18,19)
InChIKey JVIALZQUDQPEND-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 UWLU56618