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2,5-dihydroxy-1,4-cyclohexadiene-1,4-dicarboxylic acid, bis(9-octadecenyl)ester

View entire compound with spectra: 1 NMR, and 1 FTIR

2,5-dihydroxy-1,4-cyclohexadiene-1,4-dicarboxylic acid, bis(9-octadecenyl)ester
SpectraBase Compound ID 2Vll9RFhjW1
InChI InChI=1S/C44H76O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-49-43(47)39-37-42(46)40(38-41(39)45)44(48)50-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,45-46H,3-16,21-38H2,1-2H3
InChIKey UVEYSDOEDMCKHU-UHFFFAOYSA-N
Mol Weight 701.1 g/mol
Molecular Formula C44H76O6
Exact Mass 700.56419 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1Eh2DjD8nGB
Name 2,5-DIHYDROXY-1,4-CYCLOHEXADIENE-1,4-DICARBOXYLIC ACID, BIS(9-OCTADECENYL) 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 C44H76O6
InChI InChI=1S/C44H76O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-49-43(47)39-37-42(46)40(38-41(39)45)44(48)50-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,45-46H,3-16,21-38H2,1-2H3
InChIKey UVEYSDOEDMCKHU-UHFFFAOYSA-N
Literature Reference HELV. CHIM. ACTA 62, 1682(1979) Abstract-Chemical Abstracts= 91, 123440(1979)
Melting Point 62C
Molecular Weight 701.085999
Synonyms 1,4-CYCLOHEXADIENE-1,4-DICARBOXYLIC ACID, 2,5-DIHYDROXY-, BIS/9-OCTADECEN- YL/ ESTER
Technique CAPILLARY CELL: MELT (CRYSTALLINE PHASE)