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1,2-Benzenedicarboxylic acid, diethyl ester

View entire compound with spectra: 13 NMR, 24 FTIR, 1 Raman, 46 MS (GC), and 2 Near IR

1,2-Benzenedicarboxylic acid, diethyl ester
SpectraBase Compound ID 9DQDeMf4Ocj
InChI InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3
InChIKey FLKPEMZONWLCSK-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZPZc7k8Ya
Name Diethyl phthalate
Alternate Name(s) Phthalic acid diethyl ester
Comments MONAID: JP005812
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3
InChIKey FLKPEMZONWLCSK-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES CCOC(=O)c1ccccc1C(=O)OCC
SPLASH splash10-004j-0910000000-0ecc5505bd4015db9579
Source of Spectrum SRH-2022-5812-0
Wiley ID 1827816