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REL-(1R,2S,5R,6S)-5-(ACETYLOXY)-7-ENDO-CYANOBICYCLO-[4.1.0]-HEPT-3-EN-2-YL-ACETATE
SpectraBase Compound ID hWh73fStsH
InChI InChI=1S/C12H13NO4/c1-6(14)16-9-3-4-10(17-7(2)15)12-8(5-13)11(9)12/h3-4,8-12H,1-2H3/t8-,9-,10-,11-,12+/m1/s1
InChIKey UXKIGRLLLMIPFZ-OOCWMUITSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HyEg7R78ax
Name REL-(1R,2S,5R,6S)-5-(ACETYLOXY)-7-ENDO-CYANOBICYCLO-[4.1.0]-HEPT-3-EN-2-YL-ACETATE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-6(14)16-9-3-4-10(17-7(2)15)12-8(5-13)11(9)12/h3-4,8-12H,1-2H3/t8-,9-,10-,11-,12+/m1/s1
InChIKey UXKIGRLLLMIPFZ-OOCWMUITSA-N
Literature Reference Author B.KILBAS,M.BALCI
Literature Reference Citation BEIL.J.ORG.CHEM.,7,246(2011)
Literature Reference DOI 10.3762/bjoc.7.33
Molecular Weight 235.240 g/mol
Solvent CDCl3
Source File Reference UWBT9703