Systematic / IUPAC Name: 1,3-Dioxo-2-benzofuran-5-carboxylic acid
ID: Reference7299
Other Names:
4-Carboxyphthalic anhydride;
Trimellic acid anhydride;
Trimellitic acid 1,2-anhydride;
Trimellitic acid anhydride;
Trimellitic acid cyclic 1,2-anhydride
; more
Formula: C9H4O5
Class: Extractables/Leachables
Trimellitic anhydride mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 2 |
No. of Spectra | 735 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 3/28/2018 9:56:08 AM |
InChI | InChI=1S/C9H4O5/c10-7(11)4-1-2-5-6(3-4)9(13)14-8(5)12/h1-3H,(H,10,11) |
InChI Key | SRPWOOOHEPICQU-UHFFFAOYSA-N |
Canonical SMILES | C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O |
CAS | 552307 |
Splash | |
Other Names |
4-Carboxyphthalic anhydride; Trimellic acid anhydride; Trimellitic acid 1,2-anhydride; Trimellitic acid anhydride; Trimellitic acid cyclic 1,2-anhydride; 1,2,4-Benzenetricarboxylic 1,2-anhydride; 1,2,4-Benzenetricarboxylic acid 1,2-anhydride; 1,2,4-Benzenetricarboxylic acid anhydride; 1,2,4-Benzenetricarboxylic acid anhydride-1,2; 1,2,4-Benzenetricarboxylic acid, cyclic 1,2-anhydride; 1,2,4-Benzenetricarboxylic anhydride; 1,3-Dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid; 1,3-Dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid; 1,3-Dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid; 1,3-Dioxo-5-isobenzofurancarboxylic acid; 1,3-Dioxo-5-phthalancarboxylic acid; 1,3-Dioxoisobenzofuran-5-carboxylic acid; 5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-; 5-Phthalanacarboxylic acid, 1,3-dioxo-; Benzene-1,2,4-tricarboxylic acid 1,2-anhydride; Benzene-1,2,4-tricarboxylic acidanhydride; Benzene-1,2,4-tricarboxylic anhydride; Benzene-1,2,4-tricarboxylic-1,2-anhydride |
Wikipedia | Trimellitic anhydride |
ChemSpider | 10618 |
ChEBI | CHEBI:53050 |
ChemIDPlus | 000552307 |
PubChem | 11089 |
ChEMBL | CHEMBL2137687 |