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Ethyl (2R*,3R*)-3-(2-Bromophenyl)-3-hydroxy-2-[(R*)-(4-methoxyphenyl)(methylamino)methyl]propanoate
SpectraBase Compound ID IC7TxrFcmOs
InChI InChI=1S/C20H24BrNO4/c1-4-26-20(24)17(19(23)15-7-5-6-8-16(15)21)18(22-2)13-9-11-14(25-3)12-10-13/h5-12,17-19,22-23H,4H2,1-3H3/t17-,18+,19+/m1/s1
InChIKey UKDKYLRULRORBI-QYZOEREBSA-N
Mol Weight 422.32 g/mol
Molecular Formula C20H24BrNO4
Exact Mass 421.088871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CehBuspDk1q
Name ETHYL-(2R*,3R*)-3-(2-BROMOPHENYL)-3-HYDROXY-2-[(R*)-(4-METHOXYPHENYL)-(METHYLAMINO)-METHYL]-PROPANOATE
Compound Number 36B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24BrNO4
InChI InChI=1S/C20H24BrNO4/c1-4-26-20(24)17(19(23)15-7-5-6-8-16(15)21)18(22-2)13-9-11-14(25-3)12-10-13/h5-12,17-19,22-23H,4H2,1-3H3/t17-,18+,19+/m1/s1
InChIKey UKDKYLRULRORBI-QYZOEREBSA-N
Literature Reference Author F.M.CORDERO,B.B.KHAIRNAR,A.BRANDI
Literature Reference Citation EUR.J.ORG.CHEM.,2014,7122(2014)
Literature Reference DOI 10.1002/ejoc.201403025
Molecular Weight 422.319 g/mol
Solvent CDCl3
Source File Reference UWIR19539