| SpectraBase Compound ID | KzIMVVoAGI1 |
|---|---|
| InChI | InChI=1S/C20H29N3O6S/c1-5-6-11-29-18(25)13-21-17(24)12-22-20(26)19(14(2)3)23-30(27,28)16-9-7-15(4)8-10-16/h5-10,14,19,23H,11-13H2,1-4H3,(H,21,24)(H,22,26)/b6-5+/t19-/m1/s1 |
| InChIKey | GBMGVODYMUUHGV-ZMBJWTFHSA-N |
| Mol Weight | 439.53 g/mol |
| Molecular Formula | C20H29N3O6S |
| Exact Mass | 439.177707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FUN9dM6kwrb |
|---|---|
| Name | GBMGVODYMUUHGV-ZMBJWTFHSA-N |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H29N3O6S |
| InChI | InChI=1S/C20H29N3O6S/c1-5-6-11-29-18(25)13-21-17(24)12-22-20(26)19(14(2)3)23-30(27,28)16-9-7-15(4)8-10-16/h5-10,14,19,23H,11-13H2,1-4H3,(H,21,24)(H,22,26)/b6-5+/t19-/m1/s1 |
| InChIKey | GBMGVODYMUUHGV-ZMBJWTFHSA-N |
| Literature Reference Author | U.KAZMAIER,S.MAIER |
| Literature Reference Citation | J.ORG.CHEM.,64,4574(1999) |
| Literature Reference DOI | 10.1021/jo9904821 |
| Molecular Weight | 439.527 g/mol |
| Sample ID | 57901 |
| Solvent | CDCl3:CD3OD |