| SpectraBase Compound ID | 7JMMsiAhH8M |
|---|---|
| InChI | InChI=1S/C20H34O12/c1-2-3-4-5-6-7-12(23)31-20-18(16(27)14(25)11(9-22)30-20)32-19-17(28)15(26)13(24)10(8-21)29-19/h6-7,10-11,13-22,24-28H,2-5,8-9H2,1H3/b7-6+/t10-,11-,13-,14-,15+,16+,17-,18-,19+,20+/m1/s1 |
| InChIKey | QKWSDMUGIQDSEX-YRPVWPOISA-N |
| Mol Weight | 466.5 g/mol |
| Molecular Formula | C20H34O12 |
| Exact Mass | 466.205027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dmo9WmkUgfb |
|---|---|
| Name | (2E)-OCT-2-ENOATE-2-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H34O12 |
| InChI | InChI=1S/C20H34O12/c1-2-3-4-5-6-7-12(23)31-20-18(16(27)14(25)11(9-22)30-20)32-19-17(28)15(26)13(24)10(8-21)29-19/h6-7,10-11,13-22,24-28H,2-5,8-9H2,1H3/b7-6+/t10-,11-,13-,14-,15+,16+,17-,18-,19+,20+/m1/s1 |
| InChIKey | QKWSDMUGIQDSEX-YRPVWPOISA-N |
| Literature Reference Author | H.C.ZHANG,Y.WANG,C.M.YU,D.H.YU,P.P.CHEN,S.M.LIU |
| Literature Reference Citation | REC.NAT.PROD.,8,25(2014) |
| Molecular Weight | 466.483 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR15868 |