SpectraBase Compound ID | 8yMBeYnTZyu |
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InChI | InChI=1S/C29H50O2/c1-24(2)14-8-15-25(3)19(24)11-17-27(5)20(25)9-10-21-26(4)16-13-23(30)29(7,31)22(26)12-18-28(21,27)6/h19-23,30-31H,8-18H2,1-7H3/t19?,20?,21?,22?,23-,25+,26-,27-,28-,29+/m1/s1 |
InChIKey | GZRWOTDTVHIODH-ZRDKUIRTSA-N |
Mol Weight | 430.7 g/mol |
Molecular Formula | C29H50O2 |
Exact Mass | 430.381081 g/mol |
SpectraBase Spectrum ID | D6a08LkVdeE |
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Name | Epihakonanediol |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H50O2 |
InChI | InChI=1S/C29H50O2/c1-24(2)14-8-15-25(3)19(24)11-17-27(5)20(25)9-10-21-26(4)16-13-23(30)29(7,31)22(26)12-18-28(21,27)6/h19-23,30-31H,8-18H2,1-7H3/t19?,20?,21?,22?,23-,25+,26-,27-,28-,29+/m1/s1 |
InChIKey | GZRWOTDTVHIODH-ZRDKUIRTSA-N |
Molecular Weight | 430.717 g/mol |
SMILES | O[C@@]1([C@@](CC[C@@]2(C3CCC4[C@]([C@@]3(CCC12)C)(CCC1C(CCC[C@]41C)(C)C)C)C)(O)[H])C |
SPLASH | splash10-0006-0900000000-cefa5da2782ce83b4f0f |
Source of Spectrum | E1-41-265-5 |
Wiley ID | 1551896 |