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ENDO-3-AZA-N-(DIETHOXYLPHOSPHORYL)-2-OXO-2-THIABICYCLO-[2.2.2]-OCT-5-ENE;MAJOR-SULFUR-EPIMER
SpectraBase Compound ID DBQ1sSIDWZO
InChI InChI=1S/C10H18NO4PS/c1-3-14-16(12,15-4-2)11-9-5-7-10(8-6-9)17(11)13/h5,7,9-10H,3-4,6,8H2,1-2H3/t9-,10+,17?/m1/s1
InChIKey SZTHGCFYKCHCTO-ALJWHKCZSA-N
Mol Weight 279.29 g/mol
Molecular Formula C10H18NO4PS
Exact Mass 279.069416 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3tGIPBagYhI
Name ENDO-3-AZA-N-(DIETHOXYLPHOSPHORYL)-2-OXO-2-THIABICYCLO-[2.2.2]-OCT-5-ENE;MAJOR-SULFUR-EPIMER
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H18NO4PS
InChI InChI=1S/C10H18NO4PS/c1-3-14-16(12,15-4-2)11-9-5-7-10(8-6-9)17(11)13/h5,7,9-10H,3-4,6,8H2,1-2H3/t9-,10+,17?/m1/s1
InChIKey SZTHGCFYKCHCTO-ALJWHKCZSA-N
Literature Reference Author Y.ZHANG,C.J.FLANN
Literature Reference Citation J.ORG.CHEM.,63,1372(1998)
Literature Reference DOI 10.1021/jo970186t
Solvent CDCl3
Source File Reference UWSI27909