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2,5-dihydroxy-1,4-cyclohexadiene-1,4-dicarboxylic acid, bis(6-hydroxyhexyl)ester
SpectraBase Compound ID BtkTwioEEfA
InChI InChI=1S/C20H32O8/c21-9-5-1-3-7-11-27-19(25)15-13-18(24)16(14-17(15)23)20(26)28-12-8-4-2-6-10-22/h21-24H,1-14H2
InChIKey SQPMABHQWATEBZ-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C20H32O8
Exact Mass 400.209718 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5pJKWorH2Sd
Name 2,5-DIHYDROXY-1,4-CYCLOHEXADIENE-1,4-DICARBOXYLIC ACID, BIS(6-HYDROXYHEXYL) ESTER
Source of Sample J. Sinnreich, Ciba-Geigy Marienberg G.M.B.H. Bensheim, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O8
InChI InChI=1S/C20H32O8/c21-9-5-1-3-7-11-27-19(25)15-13-18(24)16(14-17(15)23)20(26)28-12-8-4-2-6-10-22/h21-24H,1-14H2
InChIKey SQPMABHQWATEBZ-UHFFFAOYSA-N
Literature Reference HELV. CHIM. ACTA 62, 1682(1979) Abstract-Chemical Abstracts= 91, 123440(1979)
Melting Point 96-97C
Molecular Weight 400.467987
Synonyms 1,4-CYCLOHEXADIENE-1,4-DICARBOXYLIC ACID, 2,5-DIHYDROXY-, BIS/6-HYDROXY- HEXYL/ ESTER
Technique FILM (CAST FROM CHCl3)