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Dimethyl 4,5-dimethylphthalate
SpectraBase Compound ID 6OcUyFR0qBy
InChI InChI=1S/C12H14O4/c1-7-5-9(11(13)15-3)10(6-8(7)2)12(14)16-4/h5-6H,1-4H3
InChIKey BMODQQWZCVNPKL-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 3tpZSmmMDPK
Name Dimethyl 4,5-dimethylphthalate
Alternate Name(s) 4,5-Dimethylbenzene-1,2-dicarboxylic acid dimethyl ester Dimethyl 4,5-dimethylbenzene-1,2-dicarboxylate Phthalic acid, 4,5-dimethyl-, dimethyl ester
CAS Registry Number 17649-59-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-7-5-9(11(13)15-3)10(6-8(7)2)12(14)16-4/h5-6H,1-4H3
InChIKey BMODQQWZCVNPKL-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES Cc1c(cc(c(c1)C(=O)OC)C(=O)OC)C
SPLASH splash10-006x-0950000000-6fb6c19729f2565ab8fe
Source of Spectrum F-32-2430-0
Wiley ID 1222174