| SpectraBase Compound ID | 3WE5zUxWYNQ |
|---|---|
| InChI | InChI=1S/C21H35N2O13P/c1-2-3-8-37(32,33-7-5-11-15(26)18(29)16(27)12(9-24)35-11)34-10-13-17(28)19(30)20(36-13)23-6-4-14(25)22-21(23)31/h4,6,11-13,15-20,24,26-30H,2-3,5,7-10H2,1H3,(H,22,25,31)/t11-,12-,13-,15+,16-,17-,18-,19-,20-,37?/m0/s1 |
| InChIKey | YKBZEGRNKXEYLN-DPCONOQBSA-N |
| Mol Weight | 554.5 g/mol |
| Molecular Formula | C21H35N2O13P |
| Exact Mass | 554.187676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EqViViQwzqM |
|---|---|
| Name | YKBZEGRNKXEYLN-DPCONOQBSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H35N2O13P |
| InChI | InChI=1S/C21H35N2O13P/c1-2-3-8-37(32,33-7-5-11-15(26)18(29)16(27)12(9-24)35-11)34-10-13-17(28)19(30)20(36-13)23-6-4-14(25)22-21(23)31/h4,6,11-13,15-20,24,26-30H,2-3,5,7-10H2,1H3,(H,22,25,31)/t11-,12-,13-,15+,16-,17-,18-,19-,20-,37?/m0/s1 |
| InChIKey | YKBZEGRNKXEYLN-DPCONOQBSA-N |
| Literature Reference Author | H.J.G.BROXTERMAN,P.A.KOOREMAN,H.VANDERELST,H.C.P.F.ROELEN,G. A.VANDERMAREL,J.H.VA |
| Literature Reference Citation | REC.TR.CH.P.-B.,109,583(1990) |
| Literature Reference DOI | 10.1002/recl.19901091204 |
| Molecular Weight | 554.488 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS2020 |