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4-IODOMETHYL-4,5-DIPHENYL-3-OXA-BICYCLO-[3.1.0]-HEXAN-2-ONE;MIXTURE_OF_DIASTEREOMERS
SpectraBase Compound ID CPHxAAskMpI
InChI InChI=1S/2C18H15IO2/c2*19-12-18(14-9-5-2-6-10-14)17(11-15(17)16(20)21-18)13-7-3-1-4-8-13/h2*1-10,15H,11-12H2/t15-,17+,18+;15-,17+,18-/m00/s1
InChIKey WAKZDBULALFWQA-WJWZLTCVSA-N
Mol Weight 780.44 g/mol
Molecular Formula C36H30I2O4
Exact Mass 780.023349 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BfhqwmXrqXU
Name 4-IODOMETHYL-4,5-DIPHENYL-3-OXA-BICYCLO-[3.1.0]-HEXAN-2-ONE;MIXTURE_OF_DIASTEREOMERS
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H30I2O4
InChI InChI=1S/2C18H15IO2/c2*19-12-18(14-9-5-2-6-10-14)17(11-15(17)16(20)21-18)13-7-3-1-4-8-13/h2*1-10,15H,11-12H2/t15-,17+,18+;15-,17+,18-/m00/s1
InChIKey WAKZDBULALFWQA-WJWZLTCVSA-N
Literature Reference Author H.U.REISSIG,G.BOETTCHER,R.ZIMMER
Literature Reference Citation CAN.J.CHEM.,82,166(2004)
Literature Reference DOI 10.1139/v03-186
Molecular Weight 780.441 g/mol
Solvent CDCl3
Source File Reference UWMZ18811