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3-Oxotabersonine

View entire compound with spectra: 2 NMR

3-Oxotabersonine
SpectraBase Compound ID Amsji4vrUlK
InChI InChI=1S/C21H22N2O3/c1-3-20-9-8-16(24)23-11-10-21(19(20)23)14-6-4-5-7-15(14)22-17(21)13(12-20)18(25)26-2/h4-9,19,22H,3,10-12H2,1-2H3/t19-,20-,21-/m0/s1
InChIKey GQTPVPFEACGBJK-ACRUOGEOSA-N
Mol Weight 350.42 g/mol
Molecular Formula C21H22N2O3
Exact Mass 350.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2J66AuQOwSa
Name 3-OXO-TABERSONINE
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N2O3
InChI InChI=1S/C21H22N2O3/c1-3-20-9-8-16(24)23-11-10-21(19(20)23)14-6-4-5-7-15(14)22-17(21)13(12-20)18(25)26-2/h4-9,19,22H,3,10-12H2,1-2H3/t19-,20-,21-/m0/s1
InChIKey GQTPVPFEACGBJK-ACRUOGEOSA-N
Literature Reference Author G.KALAUS,I.GREINER,M.KAJTAR-PEREDY,J.BRLIK,L.SZABO,C.SZANTAY
Literature Reference Citation J.ORG.CHEM.,58,1434(1993)
Literature Reference DOI 10.1021/jo00058a025
Molecular Weight 350.417 g/mol
Solvent CDCl3
Source File Reference UWCS20124