EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:16616 - 2-methylpropanal O-methyloxime

ChEBI IDCHEBI:16616
ChEBI Name2-methylpropanal O-methyloxime
Stars
ASCII Name2-methylpropanal O-methyloxime
DefinitionAn oxime O-ether that is 2-methylpropan-1-imine substituted by a methoxy group at the nitrogen atom.
Secondary ChEBI IDsCHEBI:1209, CHEBI:11624, CHEBI:19707
Last Modified13 November 2017
DownloadsMolfile
FormulaC5H11NO
Net Charge0
Average Mass101.149
Monoisotopic Mass101.08406
SMILES[H]C(=NOC)C(C)C
InChIInChI=1S/C5H11NO/c1-5(2)4-6-7-3/h4-5H,1-3H3
InChIKeyBWDHKWDASNPZLC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-methylpropanal O-methyloxime (CHEBI:16616) has functional parent 2-methylpropanal oxime (CHEBI:17502)
2-methylpropanal O-methyloxime (CHEBI:16616) is a oxime O-ether (CHEBI:36816)
Incoming Relation(s)
(1E)-2-methylpropanal O-methyloxime (CHEBI:35961) is a 2-methylpropanal O-methyloxime (CHEBI:16616)
IUPAC Name 
N-methoxy-2-methylpropan-1-imine
Synonyms  Source
2-Methylpropanal O-methyloximeKEGG COMPOUND
Isobutyraldoxime O-methyl etherChemIDplus
UniProt Name  Source
2-methylpropanal O-methyloximeUniProt
Manual XrefsDatabases
2-METHYLPROPANAL-O-METHYLOXIMEMetaCyc
C03982KEGG COMPOUND
Registry NumbersSources
Reaxys:8477792Reaxys
CAS:72705-01-2ChemIDplus