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DIBENZOYLMORPHINE;(5-ALPHA,6-ALPHA)-7,8-DIDEHYDRO-4,5-EPOXY-17-METHYLMORPHINAN-3,6-DIBENZOATE
SpectraBase Compound ID 9Urm7UPyxxb
InChI InChI=1S/C31H27NO5/c1-32-17-16-31-22-13-15-25(36-30(34)20-10-6-3-7-11-20)28(31)37-27-24(14-12-21(26(27)31)18-23(22)32)35-29(33)19-8-4-2-5-9-19/h2-15,22-23,25,28H,16-18H2,1H3/t22?,23-,25+,28+,31+/m1/s1
InChIKey TYRXZVFTBRIZFW-JMBOMPTRSA-N
Mol Weight 493.56 g/mol
Molecular Formula C31H27NO5
Exact Mass 493.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EpDEHLbuAyu
Name DIBENZOYLMORPHINE;(5-ALPHA,6-ALPHA)-7,8-DIDEHYDRO-4,5-EPOXY-17-METHYLMORPHINAN-3,6-DIBENZOATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H27NO5
InChI InChI=1S/C31H27NO5/c1-32-17-16-31-22-13-15-25(36-30(34)20-10-6-3-7-11-20)28(31)37-27-24(14-12-21(26(27)31)18-23(22)32)35-29(33)19-8-4-2-5-9-19/h2-15,22-23,25,28H,16-18H2,1H3/t22?,23-,25+,28+,31+/m1/s1
InChIKey TYRXZVFTBRIZFW-JMBOMPTRSA-N
Literature Reference Author B.CAPUANO,I.T.CROSBY,E.J.LLOYD,J.E.NEVE,D.A.TAYLOR
Literature Reference Citation AUSTR.J.CHEM.,61,422(2008)
Literature Reference DOI 10.1071/ch08060
Molecular Weight 493.559 g/mol
Sample ID 40520
Solvent CDCl3