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5,5'-(TETRADECANE-1,14-DIYL)-BIS-(2-METHYLBENZENE-1,3-DIOL)
SpectraBase Compound ID IOa57aqIGCj
InChI InChI=1S/C28H42O4/c1-21-25(29)17-23(18-26(21)30)15-13-11-9-7-5-3-4-6-8-10-12-14-16-24-19-27(31)22(2)28(32)20-24/h17-20,29-32H,3-16H2,1-2H3
InChIKey RMQFDTRLWGYIOI-UHFFFAOYSA-N
Mol Weight 442.6 g/mol
Molecular Formula C28H42O4
Exact Mass 442.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3fce7mSi95
Name 5,5'-(TETRADECANE-1,14-DIYL)-BIS-(2-METHYLBENZENE-1,3-DIOL)
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O4
InChI InChI=1S/C28H42O4/c1-21-25(29)17-23(18-26(21)30)15-13-11-9-7-5-3-4-6-8-10-12-14-16-24-19-27(31)22(2)28(32)20-24/h17-20,29-32H,3-16H2,1-2H3
InChIKey RMQFDTRLWGYIOI-UHFFFAOYSA-N
Literature Reference Author V.H.TRAN,B.D.ROUFOGALIS,C.C.DUKE
Literature Reference Citation AUSTR.J.CHEM.,50,747(1997)
Literature Reference DOI 10.1071/C96203
Molecular Weight 442.639 g/mol
Solvent CDCl3:DMSO-D6=19:1
Source File Reference UWCS15813