CHEBI:132182 - 3,3-dimethylhexane

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ChEBI Name 3,3-dimethylhexane ChEBI ID CHEBI:132182 Definition An alkane that is hexane in which the two methylene hydrogens at position 3 have been replaced by methyl groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H18 Net Charge 0 Average Mass 114.229 Monoisotopic Mass 114.14085 InChI InChI=1S/C8H18/c1-5-7-8(3,4)6-2/h5-7H2,1-4H3 InChIKey KUMXLFIBWFCMOJ-UHFFFAOYSA-N SMILES C(CC)(CCC)(C)C Metabolite of Species Details Pseudomonas putida DOT-T1E (NCBI:txid1196325) See: MetaboLights Study ChEBI Ontology Outgoing 3,3-dimethylhexane (CHEBI:132182) is a alkane (CHEBI:18310) IUPAC Name 3,3-dimethylhexane Manual Xref Database 10759 ChemSpider View more database links Registry Numbers Types Sources 1696868 Reaxys Registry Number Reaxys 563-16-6 CAS Registry Number ChemIDplus 563-16-6 CAS Registry Number NIST Chemistry WebBook Last Modified 07 December 2016