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(NACNAC)-VC-T.BU-(OTF)
SpectraBase Compound ID 5jBYt57pjlW
InChI InChI=1S/C29H41N2.C5H9.CHF3O3S.V/c1-18(2)24-13-11-14-25(19(3)4)28(24)30-22(9)17-23(10)31-29-26(20(5)6)15-12-16-27(29)21(7)8;1-5(2,3)4;2-1(3,4)8(5,6)7;/h11-21H,1-10H3;1-3H3;(H,5,6,7);/q-1;;;+2/p-1/b22-17-,31-23?;;;
InChIKey NAZIJZICNAFLEY-COJGAKOWSA-M
Mol Weight 686.79 g/mol
Molecular Formula C35H50F3N2O3SV
Exact Mass 686.293381 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KWUNAEHb5sn
Name (NACNAC)-VC-T.BU-(OTF)
Compound Number 2*OTF
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H50F3N2O3SV
InChI InChI=1S/C29H41N2.C5H9.CHF3O3S.V/c1-18(2)24-13-11-14-25(19(3)4)28(24)30-22(9)17-23(10)31-29-26(20(5)6)15-12-16-27(29)21(7)8;1-5(2,3)4;2-1(3,4)8(5,6)7;/h11-21H,1-10H3;1-3H3;(H,5,6,7);/q-1;;;+2/p-1/b22-17-,31-23?;;;
InChIKey NAZIJZICNAFLEY-COJGAKOWSA-M
Literature Reference Author F.BASULI,B.C.BAILEY,D.BROWN,J.TOMASZEWSKI,J.C.HUFFMAN,M.H.BA IK,D.J.MINDIOLA
Literature Reference Citation J.AM.CHEM.SOC.,126,10506(2004)
Literature Reference DOI 10.1021/ja0472376
Molecular Weight 686.790 g/mol
Sample ID 33122
Solvent TOLUENE-D8