| SpectraBase Compound ID | BqrMHB0wksI |
|---|---|
| InChI | InChI=1S/C20H28O2/c1-6-19(4)10-13-7-8-15-16(20(13,5)12-17(19)22)9-14(21)11-18(15,2)3/h6,9,13,15H,1,7-8,10-12H2,2-5H3/t13-,15+,19+,20-/m0/s1 |
| InChIKey | OOVJCLNBCNRUDY-RVFRGNJDSA-N |
| Mol Weight | 300.44 g/mol |
| Molecular Formula | C20H28O2 |
| Exact Mass | 300.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5VgY5zQrt3V |
|---|---|
| Name | PETALOSTIGMONE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O2 |
| InChI | InChI=1S/C20H28O2/c1-6-19(4)10-13-7-8-15-16(20(13,5)12-17(19)22)9-14(21)11-18(15,2)3/h6,9,13,15H,1,7-8,10-12H2,2-5H3/t13-,15+,19+,20-/m0/s1 |
| InChIKey | OOVJCLNBCNRUDY-RVFRGNJDSA-N |
| Literature Reference Author | M.H.GRACE,Y.JIN,G.R.WILSON,R.M.COATES |
| Literature Reference Citation | PHYTOCHEM.,67,1708(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.09.026 |
| Molecular Weight | 300.441 g/mol |
| Sample ID | 67079 |
| Solvent | CDCl3 |