| SpectraBase Compound ID | EQ85kF7FAXi |
|---|---|
| InChI | InChI=1S/C22H36O4/c1-15(11-14-26-17(3)23)10-13-21(4)16(2)8-9-19-18(21)7-6-12-22(19,5)20(24)25/h7,15-16,19H,6,8-14H2,1-5H3,(H,24,25)/t15-,16-,19+,21+,22+/m1/s1 |
| InChIKey | XQMPLFWXOSLTEF-XQAUGQPQSA-N |
| Mol Weight | 364.5 g/mol |
| Molecular Formula | C22H36O4 |
| Exact Mass | 364.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DoWyvCqzZY7 |
|---|---|
| Name | ACETOXYHYDROHALIMIC-ACID |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O4 |
| InChI | InChI=1S/C22H36O4/c1-15(11-14-26-17(3)23)10-13-21(4)16(2)8-9-19-18(21)7-6-12-22(19,5)20(24)25/h7,15-16,19H,6,8-14H2,1-5H3,(H,24,25)/t15-,16-,19+,21+,22+/m1/s1 |
| InChIKey | XQMPLFWXOSLTEF-XQAUGQPQSA-N |
| Literature Reference Author | D.I.M.D.D.MENDOCA,J.M.L.RODILLA,A.M.LITHGOW,I.S.MARCOS |
| Literature Reference Citation | PHYTOCHEM.,44,1301(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00682-6 |
| Molecular Weight | 364.525 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWUC52 |