| SpectraBase Compound ID | 5K0rLWBteLM |
|---|---|
| InChI | InChI=1S/C20H30O2/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/h6,9,13,15,17,22H,1,7-8,10-12H2,2-5H3/t13-,15+,17+,19+,20-/m0/s1 |
| InChIKey | XWOJPPAKRATBNH-SWSAAOHUSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GK1qsNVMxBy |
|---|---|
| Name | PETALOSTIGMONE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/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/h6,9,13,15,17,22H,1,7-8,10-12H2,2-5H3/t13-,15+,17+,19+,20-/m0/s1 |
| InChIKey | XWOJPPAKRATBNH-SWSAAOHUSA-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 | 302.457 g/mol |
| Sample ID | 67078 |
| Solvent | CDCl3 |