| SpectraBase Compound ID | Ga61ATdBPe4 |
|---|---|
| InChI | InChI=1S/C32H54/c1-25(2)31(9)23-21-29(7)19-13-17-27(5)15-11-12-16-28(6)18-14-20-30(8)22-24-32(10)26(3)4/h15-16,19-20,31-32H,1,3,11-14,17-18,21-24H2,2,4-10H3/b27-15+,28-16+,29-19+,30-20+ |
| InChIKey | LYHFPFHWBXEUPX-AHFVBISTSA-N |
| Mol Weight | 438.8 g/mol |
| Molecular Formula | C32H54 |
| Exact Mass | 438.422552 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ePCOaHOmy |
|---|---|
| Name | DIMETHYLSQUALENE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H54 |
| InChI | InChI=1S/C32H54/c1-25(2)31(9)23-21-29(7)19-13-17-27(5)15-11-12-16-28(6)18-14-20-30(8)22-24-32(10)26(3)4/h15-16,19-20,31-32H,1,3,11-14,17-18,21-24H2,2,4-10H3/b27-15+,28-16+,29-19+,30-20+ |
| InChIKey | LYHFPFHWBXEUPX-AHFVBISTSA-N |
| Literature Reference Author | E.ACHITOUV,P.METZGER,M.N.RAGER,C.LARGEAU |
| Literature Reference Citation | PHYTOCHEM.,65,3159(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.09.015 |
| Molecular Weight | 438.781 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI25619 |