| SpectraBase Compound ID | Fa3CMdHfi3Q |
|---|---|
| InChI | InChI=1S/C26H38O12/c1-4-14-15-7-19(28)34-11-17-12(2)5-6-26(17,33)13(3)9-35-23(32)16(15)10-36-24(14)38-25-22(31)21(30)20(29)18(8-27)37-25/h4,10,12-13,15,17-18,20-22,24-25,27,29-31,33H,5-9,11H2,1-3H3/b14-4-/t12-,13?,15-,17+,18-,20-,21+,22-,24-,25+,26+/m0/s1 |
| InChIKey | QYCPHIAOHWROAF-DBQZFWSUSA-N |
| Mol Weight | 542.6 g/mol |
| Molecular Formula | C26H38O12 |
| Exact Mass | 542.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IJ8bdl79KGA |
|---|---|
| Name | ISOJASMININ |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H38O12 |
| InChI | InChI=1S/C26H38O12/c1-4-14-15-7-19(28)34-11-17-12(2)5-6-26(17,33)13(3)9-35-23(32)16(15)10-36-24(14)38-25-22(31)21(30)20(29)18(8-27)37-25/h4,10,12-13,15,17-18,20-22,24-25,27,29-31,33H,5-9,11H2,1-3H3/b14-4-/t12-,13?,15-,17+,18-,20-,21+,22-,24-,25+,26+/m0/s1 |
| InChIKey | QYCPHIAOHWROAF-DBQZFWSUSA-N |
| Literature Reference Author | K.INOUE,T.FUJITA,H.INOUYE,H.KUWAJIMA,K.TAKAISHI,T.TANAHASHI, N.NAGAKURA,Y.ASAKA, |
| Literature Reference Citation | PHYTOCHEM.,30,1191(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95201-4 |
| Molecular Weight | 542.581 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU34204 |