| SpectraBase Compound ID | mGFA2r1Uk3 |
|---|---|
| InChI | InChI=1S/2C18H32O3/c2*1-12(19)6-7-13-17(4)9-5-8-16(2,3)14(17)10-15(20)18(13)11-21-18/h2*12-15,19-20H,5-11H2,1-4H3/t12-,13+,14-,15+,17+,18+;12-,13-,14+,15-,17-,18-/m01/s1 |
| InChIKey | HIERMFPXCQDVCW-ODZURSRQSA-N |
| Mol Weight | 592.9 g/mol |
| Molecular Formula | C36H64O6 |
| Exact Mass | 592.47029 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3JFs5WQ6qZn |
|---|---|
| Name | 7-ALPHA,13-DIHYDROXY-8,17-EPOXY-14,15-DINOR-LABDANE |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H64O6 |
| InChI | InChI=1S/2C18H32O3/c2*1-12(19)6-7-13-17(4)9-5-8-16(2,3)14(17)10-15(20)18(13)11-21-18/h2*12-15,19-20H,5-11H2,1-4H3/t12-,13+,14-,15+,17+,18+;12-,13-,14+,15-,17-,18-/m01/s1 |
| InChIKey | HIERMFPXCQDVCW-ODZURSRQSA-N |
| Literature Reference Author | J.M.L.RODILLA,D.DIEZ,J.G.URONES,P.M.ROCHA |
| Literature Reference Citation | MOLECULES,9,300(2004) |
| Literature Reference DOI | 10.3390/90500300 |
| Molecular Weight | 592.901 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5947 |