| SpectraBase Compound ID | 9mRsfvaINZJ |
|---|---|
| InChI | InChI=1S/C31H50O5/c1-19-10-15-31(25(34)36-7)17-16-28(4)20(24(31)30(19,6)35)8-9-22-26(2)13-12-23(33)27(3,18-32)21(26)11-14-29(22,28)5/h8,19,21-24,32-33,35H,9-18H2,1-7H3/t19-,21-,22-,23+,24-,26+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | VZCSIFKBQLIMDW-RYHTXFDLSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C31H50O5 |
| Exact Mass | 502.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BkBXtnnLyYp |
|---|---|
| Name | VZCSIFKBQLIMDW-RYHTXFDLSA-N |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O5 |
| InChI | InChI=1S/C31H50O5/c1-19-10-15-31(25(34)36-7)17-16-28(4)20(24(31)30(19,6)35)8-9-22-26(2)13-12-23(33)27(3,18-32)21(26)11-14-29(22,28)5/h8,19,21-24,32-33,35H,9-18H2,1-7H3/t19-,21-,22-,23+,24-,26+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | VZCSIFKBQLIMDW-RYHTXFDLSA-N |
| Literature Reference Author | F.P.SOARES,C.A.V.RONCONI,E.V.L.DACUNHA,J.M.BARBOSA-FILHO,M.S .DASILVA,R.BRAZ-FIL |
| Literature Reference Citation | MAGN.RES.CHEM.,36,608(1998) |
| Literature Reference DOI | 10.1002/(sici)1097-458x(199808)36:8<608::aid-omr335>3.3.co;2-b |
| Molecular Weight | 502.735 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBS228 |