| SpectraBase Compound ID | Lpj4ArdS6vB |
|---|---|
| InChI | InChI=1S/C20H28O3/c1-12-13-5-6-17-19(2,8-4-9-20(17,3)18(21)22)15(13)11-16-14(12)7-10-23-16/h7,10,12-13,15,17H,4-6,8-9,11H2,1-3H3,(H,21,22)/t12-,13+,15+,17-,19-,20-/m1/s1 |
| InChIKey | CGLTYYYFMFIPDN-AXOPDJDESA-N |
| Mol Weight | 316.44 g/mol |
| Molecular Formula | C20H28O3 |
| Exact Mass | 316.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AbRlOj2ITHM |
|---|---|
| Name | VINHATICOIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O3 |
| InChI | InChI=1S/C20H28O3/c1-12-13-5-6-17-19(2,8-4-9-20(17,3)18(21)22)15(13)11-16-14(12)7-10-23-16/h7,10,12-13,15,17H,4-6,8-9,11H2,1-3H3,(H,21,22)/t12-,13+,15+,17-,19-,20-/m1/s1 |
| InChIKey | CGLTYYYFMFIPDN-AXOPDJDESA-N |
| Literature Reference Author | G.M.V.JUNIOR,H.R.SILVA,T.C.BITTENCOURT,M.H.CHAVES,C.A.DESIMO NE |
| Literature Reference Citation | QUIM.NOVA,30,1658(2007) |
| Literature Reference DOI | 10.1590/s0100-40422007000700030 |
| Molecular Weight | 316.441 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT12146 |