| SpectraBase Compound ID | 4tr3elGTdqy |
|---|---|
| InChI | InChI=1S/C16H24O4/c1-9-6-11(18)13-12(10(9)7-17)16(4,14(19)20-5)8-15(13,2)3/h7,9,11,13,18H,6,8H2,1-5H3/t9-,11+,13-,16+/m1/s1 |
| InChIKey | CIWANMKRQBXGMX-NGMYAQNXSA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C16H24O4 |
| Exact Mass | 280.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3MSMtlfoh7 |
|---|---|
| Name | METHYL-BOTRYENALOATE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H24O4 |
| InChI | InChI=1S/C16H24O4/c1-9-6-11(18)13-12(10(9)7-17)16(4,14(19)20-5)8-15(13,2)3/h7,9,11,13,18H,6,8H2,1-5H3/t9-,11+,13-,16+/m1/s1 |
| InChIKey | CIWANMKRQBXGMX-NGMYAQNXSA-N |
| Literature Reference Author | J.L.REINO,R.DURAN-PATRON,I.SEGURA,R.HERNANDEZ-GALAN,H.H.RIES E,I.G.COLLADO |
| Literature Reference Citation | J.NAT.PROD.,66,344(2003) |
| Literature Reference DOI | 10.1021/np020392i |
| Molecular Weight | 280.364 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI4597 |