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Benzene-1,4-diacetic acid, dimethyl ester

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Benzene-1,4-diacetic acid, dimethyl ester
SpectraBase Compound ID 3HFOqiwHhJK
InChI InChI=1S/C12H14O4/c1-15-11(13)7-9-3-5-10(6-4-9)8-12(14)16-2/h3-6H,7-8H2,1-2H3
InChIKey WDAIQYFBXLZOHA-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9dGuPlmYAdk
Name Benzene-1,4-diacetic acid, dimethyl ester
CAS Registry Number 36076-25-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-15-11(13)7-9-3-5-10(6-4-9)8-12(14)16-2/h3-6H,7-8H2,1-2H3
InChIKey WDAIQYFBXLZOHA-UHFFFAOYSA-N
Instrument Name Cameca
Literature Reference A.S. Cavallo, M. Hilbert, Org. Magn. Resonance 17, 227 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3