| SpectraBase Compound ID | 1tUkaxazFLi |
|---|---|
| InChI | InChI=1S/C30H37BrN2O8/c1-14(34)33-19-9-15(31)5-6-16(19)26(35)41-27-8-7-23(39-3)29-21(27)11-18(24(29)32-13-27)28(36)12-20(38-2)17-10-22(29)30(28,37)25(17)40-4/h5-6,9,13,17-18,20-25,36-37H,7-8,10-12H2,1-4H3,(H,33,34)/t17-,18+,20+,21-,22+,23+,24-,25+,27+,28+,29+,30+/m1/s1 |
| InChIKey | PGMBFGFNVOXSRU-LXTXGLBJSA-N |
| Mol Weight | 633.5 g/mol |
| Molecular Formula | C30H37BrN2O8 |
| Exact Mass | 632.173329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 83pgumU6uQy |
|---|---|
| Name | N-DEETHYL-5''-BROMO-LAPPACONITINE-IMINE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H37BrN2O8 |
| InChI | InChI=1S/C30H37BrN2O8/c1-14(34)33-19-9-15(31)5-6-16(19)26(35)41-27-8-7-23(39-3)29-21(27)11-18(24(29)32-13-27)28(36)12-20(38-2)17-10-22(29)30(28,37)25(17)40-4/h5-6,9,13,17-18,20-25,36-37H,7-8,10-12H2,1-4H3,(H,33,34)/t17-,18+,20+,21-,22+,23+,24-,25+,27+,28+,29+,30+/m1/s1 |
| InChIKey | PGMBFGFNVOXSRU-LXTXGLBJSA-N |
| Literature Reference Author | J.L.WANG,X.L.SHEN,Q.H.CHEN,G.QI,W.WANG,G.QI,W.WANG,F.P.WANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,801(2009) |
| Literature Reference DOI | 10.1248/cpb.57.801 |
| Molecular Weight | 633.536 g/mol |
| Sample ID | 2812 |
| Solvent | CDCl3 |