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CHEBI:174295 - Methyl neopentyl phthalic acid

ChEBI IDCHEBI:174295
ChEBI NameMethyl neopentyl phthalic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O4
Net Charge0
Average Mass250.294
Monoisotopic Mass250.12051
SMILESCOC(=O)c1ccccc1C(=O)OCC(C)(C)C
InChIInChI=1S/C14H18O4/c1-14(2,3)9-18-13(16)11-8-6-5-7-10(11)12(15)17-4/h5-8H,9H2,1-4H3
InChIKeyLJBHDCZOMUACDL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Methyl neopentyl phthalic acid (CHEBI:174295) is a benzoate ester (CHEBI:36054)
IUPAC Name 
2-O-(2,2-dimethylpropyl) 1-O-methyl benzene-1,2-dicarboxylate
Manual XrefsDatabases
HMDB0094669HMDB
4929995ChemSpider