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(1S,5R)-6-EXO,7-ENDO-DIBENZOYLOXY-8-EXO-BENZYLOXYMETHYL-2-OXA-4-AZABICYCLO-[3.3.0]-OCTAN-3-ONE
SpectraBase Compound ID L30vJt7J3Fh
InChI InChI=1S/C28H25NO7/c30-26(19-12-6-2-7-13-19)34-24-21(17-33-16-18-10-4-1-5-11-18)23-22(29-28(32)36-23)25(24)35-27(31)20-14-8-3-9-15-20/h1-15,21-25H,16-17H2,(H,29,32)/t21-,22-,23-,24+,25+/m1/s1
InChIKey QTWKBJMVNJWHOO-LFCBLZOASA-N
Mol Weight 487.51 g/mol
Molecular Formula C28H25NO7
Exact Mass 487.163102 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LlQvMK5XEUz
Name (1S,5R)-6-EXO,7-ENDO-DIBENZOYLOXY-8-EXO-BENZYLOXYMETHYL-2-OXA-4-AZABICYCLO-[3.3.0]-OCTAN-3-ONE
Compound Number 3 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H25NO7
InChI InChI=1S/C28H25NO7/c30-26(19-12-6-2-7-13-19)34-24-21(17-33-16-18-10-4-1-5-11-18)23-22(29-28(32)36-23)25(24)35-27(31)20-14-8-3-9-15-20/h1-15,21-25H,16-17H2,(H,29,32)/t21-,22-,23-,24+,25+/m1/s1
InChIKey QTWKBJMVNJWHOO-LFCBLZOASA-N
Literature Reference Author R.BLATTNER,R.H.FURNEAUX,T.KEMMITT,P.C.TYLER,R.J.FERRIER,A.K. TIDEN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3411(1994)
Literature Reference DOI 10.1039/p19940003411
Molecular Weight 487.509 g/mol
Solvent CDCl3
Source File Reference UWRU4405