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Ibogaine

View entire compound with spectra: 4 NMR, 1 FTIR, and 6 MS (GC)

Ibogaine
SpectraBase Compound ID G0fq2WeTW9n
InChI InChI=1S/C20H26N2O/c1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19/h4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3/t12-,13+,17+,20+/m1/s1
InChIKey HSIBGVUMFOSJPD-CFDPKNGZSA-N
Mol Weight 310.44 g/mol
Molecular Formula C20H26N2O
Exact Mass 310.204513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGnDDYBO9Tw
Name IBOGAIN
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26N2O
InChI InChI=1S/C20H26N2O/c1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19/h4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3/t12-,13+,17+,20+/m1/s1
InChIKey HSIBGVUMFOSJPD-CFDPKNGZSA-N
Literature Reference Author E.WENKERT,D.W.COCHRAN,H.E.GOTTLIEB,E.W.HAGAMAN,R.B.FILHO,F.J .DE_ABREU_MATOS,M.I
Literature Reference Citation HELV.CHIM.ACTA,59,2437(1976)
Literature Reference DOI 10.1002/hlca.19760590719
Molecular Weight 310.439 g/mol
Solvent CDCl3
Source File Reference UNIW12838