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(E)-1,1,1-trifluoro-4-(hydroxy-methylamino)pent-3-en-2-one
SpectraBase Compound ID IIfMN1aR4Ey
InChI InChI=1S/C6H8F3NO2/c1-4(10(2)12)3-5(11)6(7,8)9/h3,12H,1-2H3/b4-3+
InChIKey SDSPMWLGTJLMCS-ONEGZZNKSA-N
Mol Weight 183.13 g/mol
Molecular Formula C6H8F3NO2
Exact Mass 183.050713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJBFNq3rcJu
Name (E)-1,1,1-trifluoro-4-(hydroxy-methylamino)pent-3-en-2-one
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H7F3NO2
InChI InChI=1S/C6H8F3NO2/c1-4(10(2)12)3-5(11)6(7,8)9/h3,12H,1-2H3/b4-3+
InChIKey SDSPMWLGTJLMCS-ONEGZZNKSA-N
Literature Reference Author M.A.P.MARTINS,A.F.C.FLORES,G.P.BASTOS,N.ZANATTA,H.G.BONACORS O
Literature Reference Citation J.HETCYCL.CHEM.,36,837(1999)
Literature Reference DOI 10.1002/jhet.5570360402
Molecular Weight 182.122 g/mol
Solvent CDCl3
Source File Reference UWSI24621