SpectraBase Compound ID | LBkkwDRRZ7Y |
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InChI | InChI=1S/2C30H50O/c2*1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h2*20,22-24H,9-19H2,1-8H3/t2*20-,22+,23-,24+,26+,27+,28-,29+,30-/m00/s1 |
InChIKey | DWKXFLMWEPWHNJ-AABUDRLXSA-N |
Mol Weight | 853.5 g/mol |
Molecular Formula | C60H100O2 |
Exact Mass | 852.772332 g/mol |
SpectraBase Spectrum ID | 5wJq8gkj0jF |
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Name | FRIEDELIN |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C60H100O2 |
InChI | InChI=1S/2C30H50O/c2*1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h2*20,22-24H,9-19H2,1-8H3/t2*20-,22+,23-,24+,26+,27+,28-,29+,30-/m00/s1 |
InChIKey | DWKXFLMWEPWHNJ-AABUDRLXSA-N |
Literature Reference Author | J.M.DAVID,F.A.SANTOS,M.L.D.S.GUEDES,J.P.DAVID |
Literature Reference Citation | QUIM.NOVA,26,484(2003) |
Literature Reference DOI | 10.1590/s0100-40422003000400007 |
Molecular Weight | 853.453 g/mol |
Solvent | CDCl3 |
Source File Reference | UWBT12299 |