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1,2-Benzenedicarboxylic acid, 2-(2-hydroxyethyl)hexyl methyl ester
SpectraBase Compound ID J0JU0uwO0W0
InChI InChI=1S/C17H24O5/c1-3-4-7-13(10-11-18)12-22-17(20)15-9-6-5-8-14(15)16(19)21-2/h5-6,8-9,13,18H,3-4,7,10-12H2,1-2H3
InChIKey MZFQCAIYELUNRI-UHFFFAOYSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vJ6v2myyGp
Name 1,2-Benzenedicarboxylic acid, 2-(2-hydroxyethyl)hexyl methyl ester
CAS Registry Number 76644-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-3-4-7-13(10-11-18)12-22-17(20)15-9-6-5-8-14(15)16(19)21-2/h5-6,8-9,13,18H,3-4,7,10-12H2,1-2H3
InChIKey MZFQCAIYELUNRI-UHFFFAOYSA-N
Molecular Weight 308.374 g/mol
SMILES OCCC(COC(c1c(C(=O)OC)cccc1)=O)CCCC
SPLASH splash10-03dj-0900000000-c14dc2f66eb3821c4071
Source of Spectrum KO-7-243-1
Synonyms 1-[2-(2-hydroxyethyl)hexyl]2-methyl phthalate 2-O-[2-(2-hydroxyethyl)hexyl]1-O-methyl benzene-1,2-dicarboxylate benzene-1,2-dicarboxylic acid O2-[2-(2-hydroxyethyl)hexyl]ester O1-methyl ester Methyl 2-(2-hydroxyethyl)-1-hexyl diester of phthalic acid O2-[2-(2-hydroxyethyl)hexyl]O1-methyl benzene-1,2-dicarboxylate 2-O-[2-(2-hydroxyethyl)hexyl] 1-O-methyl benzene-1,2-dicarboxylate O2-[2-(2-hydroxyethyl)hexyl] O1-methyl benzene-1,2-dicarboxylate
Wiley ID 1309778