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Benzenetetradecanoic acid, 2,5-dihydroxy-nu-oxo-4-propyl-
SpectraBase Compound ID 2ivkNGkK5sh
InChI InChI=1S/C23H36O5/c1-2-13-18-16-22(26)19(17-21(18)25)20(24)14-11-9-7-5-3-4-6-8-10-12-15-23(27)28/h16-17,25-26H,2-15H2,1H3,(H,27,28)
InChIKey GNCNNBLLVLOGKQ-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1KrnhYB7fL
Name Benzenetetradecanoic acid, 2,5-dihydroxy-nu-oxo-4-propyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-2-13-18-16-22(26)19(17-21(18)25)20(24)14-11-9-7-5-3-4-6-8-10-12-15-23(27)28/h16-17,25-26H,2-15H2,1H3,(H,27,28)
InChIKey GNCNNBLLVLOGKQ-UHFFFAOYSA-N
Molecular Weight 392.536 g/mol
SMILES Oc1cc(c(cc1C(=O)CCCCCCCCCCCCC(O)=O)O)CCC
SPLASH splash10-056u-9610000000-b389b2c567e6bb08a386
Source of Spectrum JX-2015-3-1897
Synonyms 14-(2,5-dihydroxy-4-propylphenyl)-14-oxotetradecanoic acid 14-(2,5-dihydroxy-4-propyl-phenyl)-14-oxo-tetradecanoic acid 14-[2,5-bis(oxidanyl)-4-propyl-phenyl]-14-oxidanylidene-tetradecanoic acid
Wiley ID 1725359