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(R,R)-PHTHALIC-ACID-BIS-[1-[3-(DIPHENYL-PHOSPHINOYL)-2-IODO-PHENOXYCARBONYL]-2,2-DIMETHYL-PROPYL]-ESTER
SpectraBase Compound ID 92LH6OHAivY
InChI InChI=1S/C56H50I2O10P2/c1-55(2,3)49(53(61)65-43-33-21-35-45(47(43)57)69(63,37-23-11-7-12-24-37)38-25-13-8-14-26-38)67-51(59)41-31-19-20-32-42(41)52(60)68-50(56(4,5)6)54(62)66-44-34-22-36-46(48(44)58)70(64,39-27-15-9-16-28-39)40-29-17-10-18-30-40/h7-36,49-50H,1-6H3/t49-,50-/m0/s1
InChIKey OXIDAULNESWVTL-WLTNIFSVSA-N
Mol Weight 1198.8 g/mol
Molecular Formula C56H50I2O10P2
Exact Mass 1198.096862 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4i0RnoFh9JH
Name (R,R)-PHTHALIC-ACID-BIS-[1-[3-(DIPHENYL-PHOSPHINOYL)-2-IODO-PHENOXYCARBONYL]-2,2-DIMETHYL-PROPYL]-ESTER
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H50I2O10P2
InChI InChI=1S/C56H50I2O10P2/c1-55(2,3)49(53(61)65-43-33-21-35-45(47(43)57)69(63,37-23-11-7-12-24-37)38-25-13-8-14-26-38)67-51(59)41-31-19-20-32-42(41)52(60)68-50(56(4,5)6)54(62)66-44-34-22-36-46(48(44)58)70(64,39-27-15-9-16-28-39)40-29-17-10-18-30-40/h7-36,49-50H,1-6H3/t49-,50-/m0/s1
InChIKey OXIDAULNESWVTL-WLTNIFSVSA-N
Literature Reference Author E.GOROBETS,R.M.DONALD,B.A.KEAY
Literature Reference Citation ORG.LETTERS,8,1483(2006)
Literature Reference DOI 10.1021/ol060484p
Molecular Weight 1198.764 g/mol
Sample ID 40085
Solvent CDCl3