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PEDUNCULARINE
SpectraBase Compound ID AaH5OoFmzqA
InChI InChI=1S/C20H24N2/c1-13(2)22-19-10-6-8-16(14(19)3)20(22)11-15-12-21-18-9-5-4-7-17(15)18/h4-7,9-10,12-13,16,19-21H,3,8,11H2,1-2H3/t16-,19+,20+/m0/s1
InChIKey SMPYGFGFKJAEJW-PWIZWCRZSA-N
Mol Weight 292.43 g/mol
Molecular Formula C20H24N2
Exact Mass 292.193949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dfrjcx7OaKS
Name NATURAL-PEDUNCULARINE
CAS Registry Number 34964-75-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N2
InChI InChI=1S/C20H24N2/c1-13(2)22-19-10-6-8-16(14(19)3)20(22)11-15-12-21-18-9-5-4-7-17(15)18/h4-7,9-10,12-13,16,19-21H,3,8,11H2,1-2H3/t16-,19+,20+/m0/s1
InChIKey SMPYGFGFKJAEJW-PWIZWCRZSA-N
Literature Reference Author W.J.KLAVER,H.HIEMSTRA,W.N.SPECKAMP
Literature Reference Citation J.AM.CHEM.SOC.,111,2588(1989)
Literature Reference DOI 10.1021/ja00189a036
Molecular Weight 292.424 g/mol
Solvent CDCl3
Source File Reference UWED12186