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CHEBI:103859 - 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-methylpyridin-1-ium

ChEBI IDCHEBI:103859
ChEBI Name1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-methylpyridin-1-ium
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FormulaC26H40NO
Net Charge+1
Average Mass382.612
Monoisotopic Mass382.31044
SMILESCCC(C)(C)c1ccc(OCCCC[n+]2cccc(C)c2)c(C(C)(C)CC)c1
InChIInChI=1S/C26H40NO/c1-8-25(4,5)22-14-15-24(23(19-22)26(6,7)9-2)28-18-11-10-16-27-17-12-13-21(3)20-27/h12-15,17,19-20H,8-11,16,18H2,1-7H3/q+1
InChIKeyPDJZSOPTHHVYSX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-methylpyridin-1-ium (CHEBI:103859) is a alkylbenzene (CHEBI:38976)
Manual XrefsDatabases
LSM-15210LINCS