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VDDQUJUKJTUUMJ-OCEPNSIFSA-N
SpectraBase Compound ID B5H909riP6i
InChI InChI=1S/C21H34NO2.C5H.Ti/c1-19(2,3)22-17(13-14-11-12-20(4,5)18(14)23)15-9-8-10-16(15)21(6,7)24;1-2-4-5-3-1;/h8,10,14,16,18H,9,11-13H2,1-7H3;1H;/q-3;;+3/b17-15-;;/t14-,16+,18+;;/m1../s1
InChIKey VDDQUJUKJTUUMJ-OCEPNSIFSA-N
Mol Weight 441.4 g/mol
Molecular Formula C26H35NO2Ti
Exact Mass 441.21472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3458gZk8v1G
Name VDDQUJUKJTUUMJ-OCEPNSIFSA-N
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H35NO2Ti
InChI InChI=1S/C21H34NO2.C5H.Ti/c1-19(2,3)22-17(13-14-11-12-20(4,5)18(14)23)15-9-8-10-16(15)21(6,7)24;1-2-4-5-3-1;/h8,10,14,16,18H,9,11-13H2,1-7H3;1H;/q-3;;+3/b17-15-;;/t14-,16+,18+;;/m1../s1
InChIKey VDDQUJUKJTUUMJ-OCEPNSIFSA-N
Literature Reference Author W.E.CROWE,A.T.VU
Literature Reference Citation J.AM.CHEM.SOC.,118,5508(1996)
Literature Reference DOI 10.1021/ja960887s
Molecular Weight 441.449 g/mol
Sample ID 55035
Solvent C6D6