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(1S,5R)-6-EXO,7-ENDO-DIBENZOYLOXY-8-EXO-HYDROXYMETHYL-2-OXA-4-AZABICYCLO-[3.3.0]-OCTAN-3-ONE
SpectraBase Compound ID KSMByntFkVM
InChI InChI=1S/C21H19NO7/c23-11-14-16-15(22-21(26)29-16)18(28-20(25)13-9-5-2-6-10-13)17(14)27-19(24)12-7-3-1-4-8-12/h1-10,14-18,23H,11H2,(H,22,26)/t14-,15-,16-,17+,18+/m1/s1
InChIKey UVIOELWUTIKCDY-DZVNLGKHSA-N
Mol Weight 397.38 g/mol
Molecular Formula C21H19NO7
Exact Mass 397.116152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7qdWrYZkHf
Name (1S,5R)-6-EXO,7-ENDO-DIBENZOYLOXY-8-EXO-HYDROXYMETHYL-2-OXA-4-AZABICYCLO-[3.3.0]-OCTAN-3-ONE
Compound Number 35
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19NO7
InChI InChI=1S/C21H19NO7/c23-11-14-16-15(22-21(26)29-16)18(28-20(25)13-9-5-2-6-10-13)17(14)27-19(24)12-7-3-1-4-8-12/h1-10,14-18,23H,11H2,(H,22,26)/t14-,15-,16-,17+,18+/m1/s1
InChIKey UVIOELWUTIKCDY-DZVNLGKHSA-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 397.384 g/mol
Solvent CDCl3
Source File Reference UWRU4404