| 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
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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 |