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1,4-DIHYDROXY-2-(7'-METHYL-3-METHYLENE-1'-OXO-4',7'-PEROXIDE-OCTYL)-BENZENE
SpectraBase Compound ID HmplgkN0nUK
InChI InChI=1S/C16H20O5/c1-10(15-6-7-16(2,3)21-20-15)8-14(19)12-9-11(17)4-5-13(12)18/h4-5,9,15,17-18H,1,6-8H2,2-3H3
InChIKey AZWYCFJTWBQTTG-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GkcORsN6CHa
Name 1,4-DIHYDROXY-2-(7'-METHYL-3-METHYLENE-1'-OXO-4',7'-PEROXIDE-OCTYL)-BENZENE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-10(15-6-7-16(2,3)21-20-15)8-14(19)12-9-11(17)4-5-13(12)18/h4-5,9,15,17-18H,1,6-8H2,2-3H3
InChIKey AZWYCFJTWBQTTG-UHFFFAOYSA-N
Literature Reference Author A.P.DANELUTTE,J.H.G.LAGO,M.C.M.YOUNG,M.J.KATO
Literature Reference Citation PHYTOCHEM.,64,555(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00299-1
Molecular Weight 292.332 g/mol
Solvent CDCl3
Source File Reference UWKP853