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7-ALPHA-HYDROXYCATUABINE_H;3-ALPHA,7-ALPHA-DIHYDROXY-6-BETA-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE
SpectraBase Compound ID CW86TjMTyqS
InChI InChI=1S/C14H20N2O4/c1-15-5-3-4-9(15)14(19)20-13-11-7-8(17)6-10(12(13)18)16(11)2/h3-5,8,10-13,17-18H,6-7H2,1-2H3/t8?,10-,11-,12-,13-/m0/s1
InChIKey LWRZOADKYLBJOI-XVIALMOMSA-N
Mol Weight 280.32 g/mol
Molecular Formula C14H20N2O4
Exact Mass 280.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 887P6IyufQ2
Name 7-BETA-HYDROXYCATUABINE_H;3-ALPHA,7-BETA-DIHYDROXY-6-BETA-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20N2O4
InChI InChI=1S/C14H20N2O4/c1-15-5-3-4-9(15)14(19)20-13-11-7-8(17)6-10(12(13)18)16(11)2/h3-5,8,10-13,17-18H,6-7H2,1-2H3/t8?,10-,11-,12-,13-/m0/s1
InChIKey LWRZOADKYLBJOI-XVIALMOMSA-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 280.324 g/mol
Solvent CDCl3
Source File Reference UWMZ12175