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(2S,3R)-3-METHYL-2-(2,2,2-TRIFLUOROACETAMIDO)-PENT-4-ENOIC-ACID
SpectraBase Compound ID 7vT4SuCg73V
InChI InChI=1S/C8H10F3NO3/c1-3-4(2)5(6(13)14)12-7(15)8(9,10)11/h3-5H,1H2,2H3,(H,12,15)(H,13,14)/t4-,5+/m1/s1
InChIKey SJWVXFYBDFJOFF-UHNVWZDZSA-N
Mol Weight 225.17 g/mol
Molecular Formula C8H10F3NO3
Exact Mass 225.061278 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YASQISGnMe
Name (2S,3R)-3-METHYL-2-(2,2,2-TRIFLUOROACETAMIDO)-PENT-4-ENOIC-ACID
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10F3NO3
InChI InChI=1S/C8H10F3NO3/c1-3-4(2)5(6(13)14)12-7(15)8(9,10)11/h3-5H,1H2,2H3,(H,12,15)(H,13,14)/t4-,5+/m1/s1
InChIKey SJWVXFYBDFJOFF-UHNVWZDZSA-N
Literature Reference Author C.REUTER,M.KLECZKA,S.D.MAZANCOURT,J.M.NEUDOERFL,R.KUEHNE,H.G .SCHMALZ
Literature Reference Citation EUR.J.ORG.CHEM.,2014,2664(2014)
Literature Reference DOI 10.1002/ejoc.201301875
Molecular Weight 225.168 g/mol
Solvent CDCl3
Source File Reference UWIR18537