| SpectraBase Compound ID | ESosiZU2rG0 |
|---|---|
| InChI | InChI=1S/C21H36O4/c1-7-18(2,23)13-9-16-19(3)11-8-12-20(4,17(22)25-6)15(19)10-14-21(16,5)24/h7,15-16,23-24H,1,8-14H2,2-6H3/t15-,16-,18+,19+,20+,21-/m1/s1 |
| InChIKey | NRTUVQWLJHZHET-BJLLYVFTSA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C21H36O4 |
| Exact Mass | 352.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KiOhdVesOyr |
|---|---|
| Name | METHYL-SCLAREOLATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O4 |
| InChI | InChI=1S/C21H36O4/c1-7-18(2,23)13-9-16-19(3)11-8-12-20(4,17(22)25-6)15(19)10-14-21(16,5)24/h7,15-16,23-24H,1,8-14H2,2-6H3/t15-,16-,18+,19+,20+,21-/m1/s1 |
| InChIKey | NRTUVQWLJHZHET-BJLLYVFTSA-N |
| Literature Reference Author | A.S.FELICIANO,J.M.M.D.CORRAL,J.L.LOPEZ,B.D.PASCUAL-TERESA |
| Literature Reference Citation | PHYTOCHEM.,31,1713(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83133-J |
| Molecular Weight | 352.514 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN5974 |