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MO-(N-2,6-I-PR(2)-C6H3)-(CHCME2PH)(O2CPH3)(2)

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MO-(N-2,6-I-PR(2)-C6H3)-(CHCME2PH)(O2CPH3)(2)
SpectraBase Compound ID CuvSZoegNdc
InChI InChI=1S/2C20H16O2.C12H17N.C10H12.Mo/c2*21-19(22)20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-8(2)10-6-5-7-11(9(3)4)12(10)13;1-10(2,3)9-7-5-4-6-8-9;/h2*1-15H,(H,21,22);5-9H,1-4H3;1,4-8H,2-3H3;/q;;;;+2/p-2
InChIKey SQMLVBQOXFEASE-UHFFFAOYSA-L
Mol Weight 978.1 g/mol
Molecular Formula C62H59MoNO4
Exact Mass 979.349813 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7w6c09X830h
Name MO-(N-2,6-I-PR(2)-C6H3)-(CHCME2PH)(O2CPH3)(2)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H59MoNO4
InChI InChI=1S/2C20H16O2.C12H17N.C10H12.Mo/c2*21-19(22)20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-8(2)10-6-5-7-11(9(3)4)12(10)13;1-10(2,3)9-7-5-4-6-8-9;/h2*1-15H,(H,21,22);5-9H,1-4H3;1,4-8H,2-3H3;/q;;;;+2/p-2
InChIKey SQMLVBQOXFEASE-UHFFFAOYSA-L
Literature Reference Author F.J.SCHATTENMANN,R.R.SCHROCK,W.M.DAVIS
Literature Reference Citation J.AM.CHEM.SOC.,118,3295(1996)
Literature Reference DOI 10.1021/ja9541600
Molecular Weight 978.095 g/mol
Sample ID 38303
Solvent C6D6