EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:78220 - 2-methyl-1-pyrrolinium

ChEBI IDCHEBI:78220
ChEBI Name2-methyl-1-pyrrolinium
Stars
DefinitionAn iminium ion obtained by protonation of the imino group of 2-methyl-1-pyrroline. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified16 June 2014
SubmitterKAX
DownloadsMolfile
FormulaC5H10N
Net Charge+1
Average Mass84.142
Monoisotopic Mass84.08078
SMILESCC1=[NH+]CCC1
InChIInChI=1S/C5H9N/c1-5-3-2-4-6-5/h2-4H2,1H3/p+1
InChIKeyCTSZPNIMMLSKDV-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
2-methyl-1-pyrrolinium (CHEBI:78220) is a iminium ion (CHEBI:35286)
2-methyl-1-pyrrolinium (CHEBI:78220) is conjugate acid of 2-methyl-1-pyrroline (CHEBI:78856)
Incoming Relation(s)
2-methyl-1-pyrroline (CHEBI:78856) is conjugate base of 2-methyl-1-pyrrolinium (CHEBI:78220)
IUPAC Name 
5-methyl-3,4-dihydro-2H-pyrrolium
Synonyms  Source
2-methyl-1-pyrroline(1+)ChEBI
2-MPNSUBMITTER
UniProt Name  Source
2-methyl-1-pyrrolineUniProt
Manual XrefsDatabases
CPD-16510MetaCyc
Citations