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MO-(NAD)-(CMEPH)-[OCH(CF3)(2)](2)-(2,4-LUTIDINE)

View entire compound with spectra: 1 NMR

MO-(NAD)-(CMEPH)-[OCH(CF3)(2)](2)-(2,4-LUTIDINE)
SpectraBase Compound ID FY0scTPbJFa
InChI InChI=1S/C10H15N.C8H8.C7H9N.2C3HF6O.Mo/c11-10-4-7-1-8(5-10)3-9(2-7)6-10;1-2-8-6-4-3-5-7-8;1-6-3-4-8-7(2)5-6;2*4-2(5,6)1(10)3(7,8)9;/h7-9H,1-6H2;3-7H,1H3;3-5H,1-2H3;2*1H;/q;;;2*-1;+2/t7-,8+,9-,10-;;;;;
InChIKey DGVPMGGUMWBGIQ-KIMDPPFQSA-N
Mol Weight 790.6 g/mol
Molecular Formula C31H34F12MoN2O2
Exact Mass 792.14827 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JCmJUONRoaJ
Name MO-(NAD)-(CMEPH)-[OCH(CF3)(2)](2)-(2,4-LUTIDINE)
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H34F12MoN2O2
InChI InChI=1S/C10H15N.C8H8.C7H9N.2C3HF6O.Mo/c11-10-4-7-1-8(5-10)3-9(2-7)6-10;1-2-8-6-4-3-5-7-8;1-6-3-4-8-7(2)5-6;2*4-2(5,6)1(10)3(7,8)9;/h7-9H,1-6H2;3-7H,1H3;3-5H,1-2H3;2*1H;/q;;;2*-1;+2/t7-,8+,9-,10-;;;;;
InChIKey DGVPMGGUMWBGIQ-KIMDPPFQSA-N
Literature Reference Author R.R.SCHROCK,S.LUO,J.C.LEE,N.C.ZANETTI,W.M.DAVIS
Literature Reference Citation J.AM.CHEM.SOC.,118,3883(1996)
Literature Reference DOI 10.1021/ja954155w
Molecular Weight 790.544 g/mol
Sample ID 37667
Solvent C6D6