| SpectraBase Compound ID | EqKFniynbCe |
|---|---|
| InChI | InChI=1S/C22H26ClN3O5S/c23-16-8-11-20(27)19(14-16)21(28)24-13-12-15-6-9-18(10-7-15)32(30,31)26-22(29)25-17-4-2-1-3-5-17/h6-11,14,17,27H,1-5,12-13H2,(H,24,28)(H2,25,26,29) |
| InChIKey | LKKIXCIEOZHGEP-UHFFFAOYSA-N |
| Mol Weight | 479.98 g/mol |
| Molecular Formula | C22H26ClN3O5S |
| Exact Mass | 479.12817 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GapJwClv4XM |
|---|---|
| Name | LKKIXCIEOZHGEP-UHFFFAOYSA-N |
| Compound Number | 1825 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H26ClN3O5S |
| InChI | InChI=1S/C22H26ClN3O5S/c23-16-8-11-20(27)19(14-16)21(28)24-13-12-15-6-9-18(10-7-15)32(30,31)26-22(29)25-17-4-2-1-3-5-17/h6-11,14,17,27H,1-5,12-13H2,(H,24,28)(H2,25,26,29) |
| InChIKey | LKKIXCIEOZHGEP-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 479.979 g/mol |
| Sample ID | 6524 |
| Solvent | DMSO-D6 |