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(+/-)-ISOPROPYL-4,4,4-TRIFLUORO-3-(4-METHOXYANILINO)-BUTANOATE
SpectraBase Compound ID 7zCoVETX3Af
InChI InChI=1S/C14H18F3NO3/c1-9(2)21-13(19)8-12(14(15,16)17)18-10-4-6-11(20-3)7-5-10/h4-7,9,12,18H,8H2,1-3H3/t12-/m0/s1
InChIKey IMEHCBVOLWURPL-LBPRGKRZSA-N
Mol Weight 305.3 g/mol
Molecular Formula C14H18F3NO3
Exact Mass 305.123878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C9GHmouHzpi
Name (+)-(3S)-ISOPROPYL-4,4,4-TRIFLUORO-3-(4-METHOXYANILINO)-BUTANOATE
Compound Number (S)-6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18F3NO3
InChI InChI=1S/C14H18F3NO3/c1-9(2)21-13(19)8-12(14(15,16)17)18-10-4-6-11(20-3)7-5-10/h4-7,9,12,18H,8H2,1-3H3/t12-/m0/s1
InChIKey IMEHCBVOLWURPL-LBPRGKRZSA-N
Literature Reference Author S.FUSTERO,B.PINA,E.SALAVERT,A.NAVARRO,M.C.R.D.ARELLANO,A.S.F UENTES
Literature Reference Citation J.ORG.CHEM.,67,4667(2002)
Literature Reference DOI 10.1021/jo025621k
Molecular Weight 305.297 g/mol
Solvent CDCl3
Source File Reference UWVN23346