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FBVGRGDALHILSY-MCOXZIIBSA-N
SpectraBase Compound ID 3Q8YdVgm00T
InChI InChI=1S/C20H33N3O13/c1-7(26)21-13-16(31)15(30)9(5-24)34-19(13)23-11(28)3-4-12(29)36-18-10(6-25)35-20(33)14(17(18)32)22-8(2)27/h9-10,13-20,24-25,30-33H,3-6H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)/t9-,10+,13-,14+,15-,16-,17+,18+,19-,20-/m0/s1
InChIKey FBVGRGDALHILSY-MCOXZIIBSA-N
Mol Weight 523.5 g/mol
Molecular Formula C20H33N3O13
Exact Mass 523.201338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9MRXKlWzx9L
Name FBVGRGDALHILSY-MCOXZIIBSA-N
Compound Number 5-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H33N3O13
InChI InChI=1S/C20H33N3O13/c1-7(26)21-13-16(31)15(30)9(5-24)34-19(13)23-11(28)3-4-12(29)36-18-10(6-25)35-20(33)14(17(18)32)22-8(2)27/h9-10,13-20,24-25,30-33H,3-6H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)/t9-,10+,13-,14+,15-,16-,17+,18+,19-,20-/m0/s1
InChIKey FBVGRGDALHILSY-MCOXZIIBSA-N
Literature Reference Author A.GERMER,M.G.PETER,E.KLEINPETER
Literature Reference Citation J.ORG.CHEM.,67,6328(2002)
Literature Reference DOI 10.1021/jo0163703
Molecular Weight 523.494 g/mol
Solvent Unknown
Source File Reference UWSI21886