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6,7-SECO-6-CYANOSTEMMADENINE
SpectraBase Compound ID 4qSjBFQYPbF
InChI InChI=1S/C22H27N3O3/c1-3-16-14-25(11-6-10-23)12-9-18(16)22(15-26,21(27)28-2)20-13-17-7-4-5-8-19(17)24-20/h3-5,7-8,13,18,24,26H,6,9,11-12,14-15H2,1-2H3/b16-3+
InChIKey DWYBZCZMSOLNKT-HQYXKAPLSA-N
Mol Weight 381.48 g/mol
Molecular Formula C22H27N3O3
Exact Mass 381.205242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IxAIRF8UZkj
Name 6,7-SECO-6-CYANOSTEMMADENINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H27N3O3
InChI InChI=1S/C22H27N3O3/c1-3-16-14-25(11-6-10-23)12-9-18(16)22(15-26,21(27)28-2)20-13-17-7-4-5-8-19(17)24-20/h3-5,7-8,13,18,24,26H,6,9,11-12,14-15H2,1-2H3/b16-3+
InChIKey DWYBZCZMSOLNKT-HQYXKAPLSA-N
Literature Reference Author M.ZECHES,T.RAVAO,B.RICHARD,G.MASSIOT,L.LEMEN-OLIVIER,R.VERPO ORTE
Literature Reference Citation J.NAT.PROD.,50,714(1987)
Literature Reference DOI 10.1021/np50052a023
Molecular Weight 381.475 g/mol
Solvent CDCl3
Source File Reference UWED17566