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XWPVGGHSWZEBHO-ZHWWATJMSA-N
SpectraBase Compound ID 8PmdPF8JVZW
InChI InChI=1S/C21H20N2O6/c24-9-13-17(25)18(26)19(27)21(28-13)29-20-12-4-2-1-3-11(12)15-14-10(5-7-22-15)6-8-23-16(14)20/h1-8,13,17-19,21-22,24-27H,9H2/t13-,17-,18+,19-,21+/m0/s1
InChIKey XWPVGGHSWZEBHO-ZHWWATJMSA-N
Mol Weight 396.4 g/mol
Molecular Formula C21H20N2O6
Exact Mass 396.132136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EenlQ37TRC5
Name XWPVGGHSWZEBHO-ZHWWATJMSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20N2O6
InChI InChI=1S/C21H20N2O6/c24-9-13-17(25)18(26)19(27)21(28-13)29-20-12-4-2-1-3-11(12)15-14-10(5-7-22-15)6-8-23-16(14)20/h1-8,13,17-19,21-22,24-27H,9H2/t13-,17-,18+,19-,21+/m0/s1
InChIKey XWPVGGHSWZEBHO-ZHWWATJMSA-N
Literature Reference Author K.Y.ORABI,E.LI,A.M.CLARK,C.D.HUFFORD
Literature Reference Citation J.NAT.PROD.,62,988(1999)
Literature Reference DOI 10.1021/np980457a
Molecular Weight 396.400 g/mol
Solvent CDCl3
Source File Reference UWCP8667