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1-Ethyl 2-Methyl 3-Hydroxy-5-methyl-4-nonylphthalate
SpectraBase Compound ID EKDZqrgFcHH
InChI InChI=1S/C21H32O5/c1-5-7-8-9-10-11-12-13-16-15(3)14-17(20(23)26-6-2)18(19(16)22)21(24)25-4/h14,22H,5-13H2,1-4H3
InChIKey AWEQBKOLOKHNAC-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6ssW7CBBce
Name 1-Ethyl 2-Methyl 3-Hydroxy-5-methyl-4-nonylphthalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-5-7-8-9-10-11-12-13-16-15(3)14-17(20(23)26-6-2)18(19(16)22)21(24)25-4/h14,22H,5-13H2,1-4H3
InChIKey AWEQBKOLOKHNAC-UHFFFAOYSA-N
Molecular Weight 364.482 g/mol
SMILES Oc1c(c(cc(c1CCCCCCCCC)C)C(=O)OCC)C(=O)OC
SPLASH splash10-0a4i-0392000000-5859b48ef47ec0cd2ae0
Source of Spectrum U1-2010-3737-4h
Synonyms 3-Hydroxy-5-methyl-4-nonylbenzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester 1-O-ethyl 2-O-methyl 3-hydroxy-5-methyl-4-nonylbenzene-1,2-dicarboxylate O1-ethyl O2-methyl 3-hydroxy-5-methyl-4-nonyl-benzene-1,2-dicarboxylate O1-ethyl O2-methyl 5-methyl-4-nonyl-3-oxidanyl-benzene-1,2-dicarboxylate
Wiley ID 1663913