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7-BETA-HYDROXYCATUABINE_I;6-BETA,7-BETA-DIHYDROXY-3-ALPHA-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE
SpectraBase Compound ID LjbGDNd77JA
InChI InChI=1S/C14H20N2O4/c1-15-5-3-4-9(15)14(19)20-8-6-10-12(17)13(18)11(7-8)16(10)2/h3-5,8,10-13,17-18H,6-7H2,1-2H3/t8-,10-,11-,12+,13-/m0/s1
InChIKey MVCDWVMMIFQPIY-KMLBKCHNSA-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 KuR9iXeaFCq
Name 7-BETA-HYDROXYCATUABINE_I;6-BETA,7-BETA-DIHYDROXY-3-ALPHA-[(1-METHYL-1-H-PYRROL-2-YL)-CARBANOYL]-TROPANE
Compound Number 6
Copyright Copyright © 2016-2025 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)20-8-6-10-12(17)13(18)11(7-8)16(10)2/h3-5,8,10-13,17-18H,6-7H2,1-2H3/t8-,10-,11-,12+,13-/m0/s1
InChIKey MVCDWVMMIFQPIY-KMLBKCHNSA-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 UWMZ12179