CHEBI:173828 - 2-Methylphenyl 2-methylpropanoate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Methylphenyl 2-methylpropanoate
ChEBI ID CHEBI:173828
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C11H14O2
Net Charge 0
Average Mass 178.231
Monoisotopic Mass 178.09938
InChI InChI=1S/C11H14O2/c1-8(2)11(12)13-10-7-5-4-6-9(10)3/h4-8H,1-3H3
InChIKey FDJBDZVTTXWIQM-UHFFFAOYSA-N
SMILES O(C(=O)C(C)C)C=1C(=CC=CC1)C
ChEBI Ontology
Outgoing 2-Methylphenyl 2-methylpropanoate (CHEBI:173828) is a benzoate ester (CHEBI:36054)
2-Methylphenyl 2-methylpropanoate (CHEBI:173828) is a phenols (CHEBI:33853)
IUPAC Name
(2-methylphenyl) 2-methylpropanoate
Manual Xrefs Databases
55811 ChemSpider
HMDB0037680 HMDB
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Registry Number Type Source
36438-54-7 CAS Registry Number ChemIDplus