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(E)-2-(HYDROXYIMINO)-3-[3-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOIC-ACID
SpectraBase Compound ID FDAwWo8C6GD
InChI InChI=1S/C11H8F3N3O3/c12-11(13,14)10(16-17-10)7-3-1-2-6(4-7)5-8(15-20)9(18)19/h1-4,20H,5H2,(H,18,19)/b15-8+
InChIKey BOKSTWWDXQAFDP-OVCLIPMQSA-N
Mol Weight 287.2 g/mol
Molecular Formula C11H8F3N3O3
Exact Mass 287.051776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 37wMYNXvNIq
Name (E)-2-(HYDROXYIMINO)-3-[3-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]-PHENYL]-PROPANOIC-ACID
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H7F3N3O3
InChI InChI=1S/C11H8F3N3O3/c12-11(13,14)10(16-17-10)7-3-1-2-6(4-7)5-8(15-20)9(18)19/h1-4,20H,5H2,(H,18,19)/b15-8+
InChIKey BOKSTWWDXQAFDP-OVCLIPMQSA-N
Literature Reference Author F.HENTSCHEL,B.RAIMER,G.KELTER,H.H.FIEBIG,F.SASSE,T.LINDEL
Literature Reference Citation EUR.J.ORG.CHEM.,2014,2120(2014)
Literature Reference DOI 10.1002/ejoc.201301717
Molecular Weight 286.190 g/mol
Solvent DMSO-D6
Source File Reference UWIR19592