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2,5-Cyclohexadiene-1,4-dione, 2,2'-(1,14-tetradecanediyl)bis[6-methoxy-
SpectraBase Compound ID JhgZhzntso2
InChI InChI=1S/C28H38O6/c1-33-25-19-23(29)17-21(27(25)31)15-13-11-9-7-5-3-4-6-8-10-12-14-16-22-18-24(30)20-26(34-2)28(22)32/h17-20H,3-16H2,1-2H3
InChIKey LNEXHZADEQVPQL-UHFFFAOYSA-N
Mol Weight 470.6 g/mol
Molecular Formula C28H38O6
Exact Mass 470.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57zbWe4eTwv
Name 2,5-Cyclohexadiene-1,4-dione, 2,2'-(1,14-tetradecanediyl)bis[6-methoxy-
CAS Registry Number 61621-86-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O6
InChI InChI=1S/C28H38O6/c1-33-25-19-23(29)17-21(27(25)31)15-13-11-9-7-5-3-4-6-8-10-12-14-16-22-18-24(30)20-26(34-2)28(22)32/h17-20H,3-16H2,1-2H3
InChIKey LNEXHZADEQVPQL-UHFFFAOYSA-N
Molecular Weight 470.606 g/mol
SMILES C=1(C(C(CCCCCCCCCCCCCCC=2C(C(OC)=CC(C2)=O)=O)=CC(C1)=O)=O)OC
SPLASH splash10-0uk9-0900400000-02d53ff23b884ba7c03f
Source of Spectrum B-29-1986-0
Synonyms 2-methoxy-6-[14-(5-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl)tetradecyl]benzo-1,4-quinone 6,6'-(tetradecane-1,14-diyl)di(2-methoxy-1,4-benzoquinone) 6,6'-(tetradecane-1,14-diyl)di(3-hydroxy-6-methoxy-1,4-benzoquinone)
Wiley ID 1392899