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CATUABINE_E_N-OXIDE;3-ALPHA,6-BETA-DI-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE_N-OXIDE
SpectraBase Compound ID LYdhxiWhyRk
InChI InChI=1S/C20H25N3O5/c1-21-8-4-6-15(21)19(24)27-14-10-13-11-18(17(12-14)23(13,3)26)28-20(25)16-7-5-9-22(16)2/h4-9,13-14,17-18H,10-12H2,1-3H3/t13-,14+,17-,18+,23-/m0/s1
InChIKey GMTPJCQCKXACMX-XCVXBNCDSA-N
Mol Weight 387.44 g/mol
Molecular Formula C20H25N3O5
Exact Mass 387.179421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fPLE8AOzM3
Name CATUABINE_E_N-OXIDE;3-ALPHA,6-BETA-DI-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE_N-OXIDE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H25N3O5
InChI InChI=1S/C20H25N3O5/c1-21-8-4-6-15(21)19(24)27-14-10-13-11-18(17(12-14)23(13,3)26)28-20(25)16-7-5-9-22(16)2/h4-9,13-14,17-18H,10-12H2,1-3H3/t13-,14+,17-,18+,23-/m0/s1
InChIKey GMTPJCQCKXACMX-XCVXBNCDSA-N
Literature Reference Author B.ZANOLARI,D.GUILET,A.MARSTON,E.F.QUEIROZ,M.D.Q.PAULO,K.HOST ETTMANN
Literature Reference Citation J.NAT.PROD.,68,1153(2005)
Literature Reference DOI 10.1021/np040144h
Molecular Weight 387.436 g/mol
Solvent CDCl3
Source File Reference UWMZ12177