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14-BENZOYLNUDICAULIDINE
SpectraBase Compound ID 4YhemmViITE
InChI InChI=1S/C31H43NO7/c1-6-32-16-28(2)13-12-21(37-4)30-19-14-18-20(36-3)15-29(34,31(35,27(30)32)25(38-5)24(28)30)22(19)23(18)39-26(33)17-10-8-7-9-11-17/h7-11,18-25,27,34-35H,6,12-16H2,1-5H3/t18?,19-,20+,21+,22-,23+,24-,25+,27?,28+,29-,30+,31-/m1/s1
InChIKey LDZDUGYTLKWPEI-DLXOTOKGSA-N
Mol Weight 541.7 g/mol
Molecular Formula C31H43NO7
Exact Mass 541.303953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JSMjW6iDJ4b
Name 14-BENZOYLNUDICAULIDINE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO7
InChI InChI=1S/C31H43NO7/c1-6-32-16-28(2)13-12-21(37-4)30-19-14-18-20(36-3)15-29(34,31(35,27(30)32)25(38-5)24(28)30)22(19)23(18)39-26(33)17-10-8-7-9-11-17/h7-11,18-25,27,34-35H,6,12-16H2,1-5H3/t18?,19-,20+,21+,22-,23+,24-,25+,27?,28+,29-,30+,31-/m1/s1
InChIKey LDZDUGYTLKWPEI-DLXOTOKGSA-N
Literature Reference Author M.REINA,A.MADINAVEITIA,G.DELAFUENTE
Literature Reference Citation PHYTOCHEM.,45,1707(1997)
Literature Reference DOI 10.1016/S0031-9422(97)00194-5
Molecular Weight 541.685 g/mol
Solvent CDCl3
Source File Reference UWSP415