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(1R*,4R*,5R*,6S*)-8-DIETHYLPHOSPHORYLOXY-2-THIABICYCLO-[2.2.2]-OCT-7-ENE-5,6-DICARBOXYLIC-ACID-ANIHIDRIDE
SpectraBase Compound ID JBAN1YTlMJ5
InChI InChI=1S/C13H17O7PS/c1-3-17-21(16,18-4-2)20-8-5-9-11-10(7(8)6-22-9)12(14)19-13(11)15/h5,7,9-11H,3-4,6H2,1-2H3/t7-,9+,10+,11-/m0/s1
InChIKey NNEWVUNIMSJBFU-IANFPDNMSA-N
Mol Weight 348.31 g/mol
Molecular Formula C13H17O7PS
Exact Mass 348.043261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CVvrdG1ItF
Name (1R*,4R*,5R*,6S*)-8-DIETHYLPHOSPHORYLOXY-2-THIABICYCLO-[2.2.2]-OCT-7-ENE-5,6-DICARBOXYLIC-ACID-ANIHIDRIDE
Compound Number 20A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17O7PS
InChI InChI=1S/C13H17O7PS/c1-3-17-21(16,18-4-2)20-8-5-9-11-10(7(8)6-22-9)12(14)19-13(11)15/h5,7,9-11H,3-4,6H2,1-2H3/t7-,9+,10+,11-/m0/s1
InChIKey NNEWVUNIMSJBFU-IANFPDNMSA-N
Literature Reference Author D.E.WARD,Y.GAI,W.M.ZOGHAIB
Literature Reference Citation CAN.J.CHEM.,69,1487(1991)
Literature Reference DOI 10.1139/v91-220
Molecular Weight 348.308 g/mol
Solvent CDCl3
Source File Reference UWVP3370