| SpectraBase Compound ID | 6Ig0MuNQ3Be |
|---|---|
| InChI | InChI=1S/C22H35NO6/c1-4-23-10-19(25)6-5-16(24)21-14(19)8-12(17(21)23)20(26)9-13(28-2)11-7-15(21)22(20,27)18(11)29-3/h11-18,24-27H,4-10H2,1-3H3/t11-,12+,13+,14?,15?,16+,17?,18+,19-,20+,21+,22+/m1/s1 |
| InChIKey | DTOLGJFFBKWDJX-ZEEQINFSSA-N |
| Mol Weight | 409.5 g/mol |
| Molecular Formula | C22H35NO6 |
| Exact Mass | 409.246438 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CeVfFT8RfyA |
|---|---|
| Name | LAPACONIDINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H35NO6 |
| InChI | InChI=1S/C22H35NO6/c1-4-23-10-19(25)6-5-16(24)21-14(19)8-12(17(21)23)20(26)9-13(28-2)11-7-15(21)22(20,27)18(11)29-3/h11-18,24-27H,4-10H2,1-3H3/t11-,12+,13+,14?,15?,16+,17?,18+,19-,20+,21+,22+/m1/s1 |
| InChIKey | DTOLGJFFBKWDJX-ZEEQINFSSA-N |
| Literature Reference Author | S.W.PELLETIER,N.V.MODY,R.S.SAWHNEY |
| Literature Reference Citation | CAN.J.CHEM.,57,1652(1979) |
| Literature Reference DOI | 10.1139/v79-266 |
| Molecular Weight | 409.523 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED2243 |