| SpectraBase Compound ID | DZUrgDVqI4c |
|---|---|
| InChI | InChI=1S/2C20H25N3O5S/c2*1-13(24)23-16(7-12-29-2)18(25)17(20(23)27)19(26)21-14-3-5-15(6-4-14)22-8-10-28-11-9-22/h3-6,16,25H,7-12H2,1-2H3,(H,21,26);3-6,16,21,26H,7-12H2,1-2H3/b;19-17+ |
| InChIKey | AWSRPJATFLNMJV-YFEKSWFOSA-N |
| Mol Weight | 419.5 g/mol |
| Molecular Formula | C20H25N3O5S |
| Exact Mass | 419.151492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Vw7ZPX2diT |
|---|---|
| Name | AB-TAUTOMER |
| Compound Number | 3F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H25N3O5S |
| InChI | InChI=1S/2C20H25N3O5S/c2*1-13(24)23-16(7-12-29-2)18(25)17(20(23)27)19(26)21-14-3-5-15(6-4-14)22-8-10-28-11-9-22/h3-6,16,25H,7-12H2,1-2H3,(H,21,26);3-6,16,21,26H,7-12H2,1-2H3/b;19-17+ |
| InChIKey | AWSRPJATFLNMJV-YFEKSWFOSA-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 | 419.496 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU77557 |