xi-2,3-Dimethylhexane (CHEBI:173398)

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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	xi-2,3-Dimethylhexane

ChEBI ID	CHEBI:173398

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H18

Net Charge

Average Mass

114.232

Monoisotopic Mass

114.14085

InChI

InChI=1S/C8H18/c1-5-6-8(4)7(2)3/h7-8H,5-6H2,1-4H3

InChIKey

JXPOLSKBTUYKJB-UHFFFAOYSA-N

SMILES

C(C(C)C)(CCC)C

ChEBI Ontology
Outgoing	xi-2,3-Dimethylhexane (CHEBI:173398) is a alkane (CHEBI:18310)

IUPAC Name

2,3-dimethylhexane

Registry Number	Type	Source
584-94-1	CAS Registry Number	ChemIDplus