9-methyl-tridecanoic acid (CHEBI:179788)

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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	9-methyl-tridecanoic acid

ChEBI ID	CHEBI:179788

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H28O2

Net Charge

Average Mass

228.376

Monoisotopic Mass

228.20893

InChI

InChI=1S/C14H28O2/c1-3-4-10-13(2)11-8-6-5-7-9-12-14(15)16/h13H,3-12H2,1-2H3,(H,15,16)

InChIKey

YANLIXDCINUGHT-UHFFFAOYSA-N

SMILES

OC(=O)CCCCCCCC(CCCC)C

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	9-methyl-tridecanoic acid (CHEBI:179788) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

9-methyltridecanoic acid