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2,5-Diacetyl-terephthalic acid
SpectraBase Compound ID U0jMxzytbA
InChI InChI=1S/C12H10O6/c1-5(13)7-3-10(12(17)18)8(6(2)14)4-9(7)11(15)16/h3-4H,1-2H3,(H,15,16)(H,17,18)
InChIKey BCCKNCHLCMNBOV-UHFFFAOYSA-N
Mol Weight 250.21 g/mol
Molecular Formula C12H10O6
Exact Mass 250.047738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kOTjaHfgEf
Name 2,5-Diacetyl-terephthalic acid
Alternate Name(s) 2,5-Diethanoylterephthalic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O6
InChI InChI=1S/C12H10O6/c1-5(13)7-3-10(12(17)18)8(6(2)14)4-9(7)11(15)16/h3-4H,1-2H3,(H,15,16)(H,17,18)
InChIKey BCCKNCHLCMNBOV-UHFFFAOYSA-N
Molecular Weight 250.206 g/mol
SMILES OC(c1cc(c(C(=O)O)cc1C(=O)C)C(=O)C)=O
SPLASH splash10-000f-9340000000-b4546d8aed4ca155b879
Wiley ID 1455177