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OPMXQGODURRRDT-WHZJULEDSA-N
SpectraBase Compound ID 2gzQ9L2GV0r
InChI InChI=1S/C21H27NO9/c1-12(23)28-18-10-17(22-27-11-16-8-6-5-7-9-16)19(29-13(2)24)21(31-15(4)26)20(18)30-14(3)25/h5-9,17-22H,10-11H2,1-4H3/t17-,18-,19+,20-,21-/m0/s1
InChIKey OPMXQGODURRRDT-WHZJULEDSA-N
Mol Weight 437.45 g/mol
Molecular Formula C21H27NO9
Exact Mass 437.168581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJBs0FazJsA
Name OPMXQGODURRRDT-WHZJULEDSA-N
Compound Number 37A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27NO9
InChI InChI=1S/C21H27NO9/c1-12(23)28-18-10-17(22-27-11-16-8-6-5-7-9-16)19(29-13(2)24)21(31-15(4)26)20(18)30-14(3)25/h5-9,17-22H,10-11H2,1-4H3/t17-,18-,19+,20-,21-/m0/s1
InChIKey OPMXQGODURRRDT-WHZJULEDSA-N
Literature Reference Author J.MARCO-CONTELLES,C.POZUELO,M.L.JIMENO,L.MARTINEZ,A.MARTINEZ -GRAU
Literature Reference Citation J.ORG.CHEM.,57,2625(1992)
Literature Reference DOI 10.1021/jo00035a017
Molecular Weight 437.447 g/mol
Solvent CDCl3
Source File Reference UWCS1638