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Epihakonanediol
SpectraBase Compound ID 8yMBeYnTZyu
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6a08LkVdeE
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