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Propanedioic acid, (2,5-dimethylphenyl)methyl-, diethyl ester
SpectraBase Compound ID CDZDFD0KlV4
InChI InChI=1S/C16H22O4/c1-6-19-14(17)16(5,15(18)20-7-2)13-10-11(3)8-9-12(13)4/h8-10H,6-7H2,1-5H3
InChIKey AFJQWFJEGDCXRA-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJjOy5UGsXQ
Name Propanedioic acid, (2,5-dimethylphenyl)methyl-, diethyl ester
Alternate Name(s) Diethyl (2,5-dimethylpheny)methylpropanedioate Diethyl 2-(2,5-dimethylphenyl)-2-methylmalonate
CAS Registry Number 83026-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-6-19-14(17)16(5,15(18)20-7-2)13-10-11(3)8-9-12(13)4/h8-10H,6-7H2,1-5H3
InChIKey AFJQWFJEGDCXRA-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES C(c1c(ccc(c1)C)C)(C(=O)OCC)(C(=O)OCC)C
SPLASH splash10-0a59-0940000000-cc3b5af184b76c9c18c7
Source of Spectrum J-47-4700-0
Wiley ID 1282044