| SpectraBase Compound ID | 36SD52z4mRY |
|---|---|
| InChI | InChI=1S/2C20H30N2O4S/c2*23-17-15(11-12-27)22(19(25)13-7-3-1-4-8-13)20(26)16(17)18(24)21-14-9-5-2-6-10-14/h13-15,26-27H,1-12H2,(H,21,24);13-15,21,24,27H,1-12H2/b;18-16- |
| InChIKey | FUYHBKCMOWJPDE-DTCMMOQTSA-N |
| Mol Weight | 394.53 g/mol |
| Molecular Formula | C20H30N2O4S |
| Exact Mass | 394.192629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5VLKfhbmrcS |
|---|---|
| Name | CD-TAUTOMER |
| Compound Number | 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H30N2O4S |
| InChI | InChI=1S/2C20H30N2O4S/c2*23-17-15(11-12-27)22(19(25)13-7-3-1-4-8-13)20(26)16(17)18(24)21-14-9-5-2-6-10-14/h13-15,26-27H,1-12H2,(H,21,24);13-15,21,24,27H,1-12H2/b;18-16- |
| InChIKey | FUYHBKCMOWJPDE-DTCMMOQTSA-N |
| Literature Reference Author | Y.C.JEONG,M.G.MOLONEY |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,9,1899(2013) |
| Literature Reference DOI | 10.3762/bjoc.9.224 |
| Molecular Weight | 394.529 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU77553 |