John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9actwP4XDZv SpectraBase Spectrum ID=2AnRXbNgj6P

(accessed ).
KIPUKASIN_B
SpectraBase Compound ID 9actwP4XDZv
InChI InChI=1S/C20H22N2O10/c1-9-6-11(25)7-12(29-3)15(9)19(27)32-16-13(8-23)31-18(17(16)30-10(2)24)22-5-4-14(26)21-20(22)28/h4-7,13,16-18,23,25H,8H2,1-3H3,(H,21,26,28)/t13-,16-,17-,18-/m1/s1
InChIKey ULPUBSPPYRXUOZ-BNEJOLLZSA-N
Mol Weight 450.4 g/mol
Molecular Formula C20H22N2O10
Exact Mass 450.127445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AnRXbNgj6P
Name KIPUKASIN_B
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N2O10
InChI InChI=1S/C20H22N2O10/c1-9-6-11(25)7-12(29-3)15(9)19(27)32-16-13(8-23)31-18(17(16)30-10(2)24)22-5-4-14(26)21-20(22)28/h4-7,13,16-18,23,25H,8H2,1-3H3,(H,21,26,28)/t13-,16-,17-,18-/m1/s1
InChIKey ULPUBSPPYRXUOZ-BNEJOLLZSA-N
Literature Reference Author P.JIAO,S.V.MUDUR,J.B.GLOER,D.T.WICKLOW
Literature Reference Citation J.NAT.PROD.,70,1308(2007)
Literature Reference DOI 10.1021/np070241l
Molecular Weight 450.402 g/mol
Sample ID 31414
Solvent CDCl3
SpectraBase Batch ID F7VxIRQpo0Q