| SpectraBase Compound ID | 9tLpIS4tpC0 |
|---|---|
| InChI | InChI=1S/C68H134O2/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-59-70-67(68(11,69)58-44-56-66(10)54-42-50-63(7)48-39-46-61(4)5)57-43-55-65(9)53-41-52-64(8)51-40-49-62(6)47-38-45-60(2)3/h19-20,55,60-64,66-67,69H,12-18,21-54,56-59H2,1-11H3/b20-19+,65-55+/t62-,63+,64-,66+,67?,68?/m0/s1 |
| InChIKey | TVZWVJZYGIVMQR-QNYRWKFZSA-N |
| Mol Weight | 983.8 g/mol |
| Molecular Formula | C68H134O2 |
| Exact Mass | 983.038384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 99cSmt2Ycg4 |
|---|---|
| Name | TVZWVJZYGIVMQR-QNYRWKFZSA-N |
| Compound Number | TRANS-#4-MIXTURE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H134O2 |
| InChI | InChI=1S/C68H134O2/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-59-70-67(68(11,69)58-44-56-66(10)54-42-50-63(7)48-39-46-61(4)5)57-43-55-65(9)53-41-52-64(8)51-40-49-62(6)47-38-45-60(2)3/h19-20,55,60-64,66-67,69H,12-18,21-54,56-59H2,1-11H3/b20-19+,65-55+/t62-,63+,64-,66+,67?,68?/m0/s1 |
| InChIKey | TVZWVJZYGIVMQR-QNYRWKFZSA-N |
| Literature Reference Author | M.N.RAGER,P.METZGER |
| Literature Reference Citation | PHYTOCHEM.,54,427(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00118-7 |
| Molecular Weight | 983.811 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU20850 |