| SpectraBase Compound ID | BoWr3pHZLJr |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-13(12-17(21)22)6-8-15-14(2)7-9-16-19(15,3)10-5-11-20(16,4)18(23)24/h12,15-16H,2,5-11H2,1,3-4H3,(H,21,22)(H,23,24)/b13-12-/t15?,16?,19-,20+/m1/s1 |
| InChIKey | QYCOHMYDSOZCQD-ZSUGWDHPSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4REJTdvLKrz |
|---|---|
| Name | LABDA-8(17),13(Z)-DIENE-15,19-DIOIC-ACID |
| Compound Number | 4Z |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-13(12-17(21)22)6-8-15-14(2)7-9-16-19(15,3)10-5-11-20(16,4)18(23)24/h12,15-16H,2,5-11H2,1,3-4H3,(H,21,22)(H,23,24)/b13-12-/t15?,16?,19-,20+/m1/s1 |
| InChIKey | QYCOHMYDSOZCQD-ZSUGWDHPSA-N |
| Literature Reference Author | S.J.LIN,R.E.SHORT,S.P.FORD,E.E.GRINGS,J.P.N.ROSAZZA |
| Literature Reference Citation | J.NAT.PROD.,61,51(1998) |
| Literature Reference DOI | 10.1021/np970372u |
| Molecular Weight | 334.456 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP510 |