| SpectraBase Compound ID | LTDDOdNzNzR |
|---|---|
| InChI | InChI=1S/C20H33N3O13/c1-7(26)21-13-16(31)15(30)9(5-24)34-19(13)23-11(28)3-4-12(29)36-18-10(6-25)35-20(33)14(17(18)32)22-8(2)27/h9-10,13-20,24-25,30-33H,3-6H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)/t9-,10+,13-,14+,15-,16-,17+,18+,19-,20+/m0/s1 |
| InChIKey | FBVGRGDALHILSY-YXTPQBRLSA-N |
| Mol Weight | 523.5 g/mol |
| Molecular Formula | C20H33N3O13 |
| Exact Mass | 523.201338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L2Vv2f1f9iA |
|---|---|
| Name | FBVGRGDALHILSY-YXTPQBRLSA-N |
| Compound Number | 5-BETA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H33N3O13 |
| InChI | InChI=1S/C20H33N3O13/c1-7(26)21-13-16(31)15(30)9(5-24)34-19(13)23-11(28)3-4-12(29)36-18-10(6-25)35-20(33)14(17(18)32)22-8(2)27/h9-10,13-20,24-25,30-33H,3-6H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)/t9-,10+,13-,14+,15-,16-,17+,18+,19-,20+/m0/s1 |
| InChIKey | FBVGRGDALHILSY-YXTPQBRLSA-N |
| Literature Reference Author | A.GERMER,M.G.PETER,E.KLEINPETER |
| Literature Reference Citation | J.ORG.CHEM.,67,6328(2002) |
| Literature Reference DOI | 10.1021/jo0163703 |
| Molecular Weight | 523.494 g/mol |
| Solvent | Unknown |
| Source File Reference | UWSI21887 |