| SpectraBase Compound ID | 2f8s4UoRpDc |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-18-11-13-27(5)15-16-28(6)20-9-10-22-26(3,4)23(31)17-24(32)30(22,8)21(20)12-14-29(28,7)25(27)19(18)2/h9,18-19,21-25,31-32H,10-17H2,1-8H3/t18-,19+,21+,22+,23+,24+,25-,27-,28-,29+,30-/m1/s1 |
| InChIKey | XAEHAXYUIJPVHK-TZIWFCPOSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KP11PJGnGcr |
|---|---|
| Name | BAUER-7-ENE-1,3-DIOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-18-11-13-27(5)15-16-28(6)20-9-10-22-26(3,4)23(31)17-24(32)30(22,8)21(20)12-14-29(28,7)25(27)19(18)2/h9,18-19,21-25,31-32H,10-17H2,1-8H3/t18-,19+,21+,22+,23+,24+,25-,27-,28-,29+,30-/m1/s1 |
| InChIKey | XAEHAXYUIJPVHK-TZIWFCPOSA-N |
| Literature Reference Author | D.WANG,M.XIA,Z.CUI |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,775(2006) |
| Literature Reference DOI | 10.1248/cpb.54.775 |
| Molecular Weight | 442.726 g/mol |
| Sample ID | 54846 |
| Solvent | CDCl3 |