| SpectraBase Compound ID | IwhCITqj3oZ |
|---|---|
| InChI | InChI=1S/C21H31NO4/c1-19-5-4-15(26-3)21-11-6-10-13(25-2)8-20(24,16(11)17(10)23)12(7-14(19)21)18(21)22-9-19/h9-18,23-24H,4-8H2,1-3H3/t10-,11?,12+,13+,14?,15+,16?,17+,18-,19+,20+,21-/m1/s1 |
| InChIKey | XJSOPBATEOQJSE-RCALTRLPSA-N |
| Mol Weight | 361.48 g/mol |
| Molecular Formula | C21H31NO4 |
| Exact Mass | 361.225308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8dByUe6NO5M |
|---|---|
| Name | N-DEETHYL-N-19-DIDEHYDROSACHACONITINE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31NO4 |
| InChI | InChI=1S/C21H31NO4/c1-19-5-4-15(26-3)21-11-6-10-13(25-2)8-20(24,16(11)17(10)23)12(7-14(19)21)18(21)22-9-19/h9-18,23-24H,4-8H2,1-3H3/t10-,11?,12+,13+,14?,15+,16?,17+,18-,19+,20+,21-/m1/s1 |
| InChIKey | XJSOPBATEOQJSE-RCALTRLPSA-N |
| Literature Reference Author | J.G.DIAZ,J.G.RUIZA,W.HERZ |
| Literature Reference Citation | PHYTOCHEM.,66,837(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.01.019 |
| Molecular Weight | 361.481 g/mol |
| Solvent | COHCl3 |
| Source File Reference | UWLU32559 |