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(3''R,5''S,1'''S)-DIMETHYL-2-[[5-(1-BENZYLOXYCARBONYLAMINO)-2-METHYLPROPYL]-2-OXOTETRAHYDRO-3-FURANYL]-METHYLMALONATE
SpectraBase Compound ID GljHJLrCRUi
InChI InChI=1S/C22H29NO8/c1-13(2)18(23-22(27)30-12-14-8-6-5-7-9-14)17-11-15(19(24)31-17)10-16(20(25)28-3)21(26)29-4/h5-9,13,15-18H,10-12H2,1-4H3,(H,23,27)/t15-,17+,18-/m1/s1
InChIKey ABXQIYWNDUAWNC-BPQIPLTHSA-N
Mol Weight 435.47 g/mol
Molecular Formula C22H29NO8
Exact Mass 435.189317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEMa380b2Xs
Name (3''R,5''S,1'''S)-DIMETHYL-2-[[5-(1-BENZYLOXYCARBONYLAMINO)-2-METHYLPROPYL]-2-OXOTETRAHYDRO-3-FURANYL]-METHYLMALONATE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO8
InChI InChI=1S/C22H29NO8/c1-13(2)18(23-22(27)30-12-14-8-6-5-7-9-14)17-11-15(19(24)31-17)10-16(20(25)28-3)21(26)29-4/h5-9,13,15-18H,10-12H2,1-4H3,(H,23,27)/t15-,17+,18-/m1/s1
InChIKey ABXQIYWNDUAWNC-BPQIPLTHSA-N
Literature Reference Author S.STEURER,J.PODLECH
Literature Reference Citation ORG.LETTERS,1,481(1999)
Literature Reference DOI 10.1021/ol990672y
Molecular Weight 435.474 g/mol
Solvent CDCl3
Source File Reference UWSI26208