| SpectraBase Compound ID | I2Qpkuw0GjA |
|---|---|
| InChI | InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31-/m1/s1 |
| InChIKey | BDSLWVNVMSMEIV-JWXWWSHWSA-N |
| Mol Weight | 456.8 g/mol |
| Molecular Formula | C31H52O2 |
| Exact Mass | 456.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G58Gpyk5lwd |
|---|---|
| Name | ISOMER-#2 |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O2 |
| InChI | InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31-/m1/s1 |
| InChIKey | BDSLWVNVMSMEIV-JWXWWSHWSA-N |
| Literature Reference Author | K.BLASZCZYK,Z.PARYZEK |
| Literature Reference Citation | MAGN.RES.CHEM.,34,840(1996) |
| Literature Reference DOI | 10.1002/(sici)1097-458x(199610)34:10<840::aid-omr1908>3.3.co;2-b |
| Molecular Weight | 456.753 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2058 |