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CHEBI:149492 - 5,5-dimethyl-1-pyrroline

ChEBI IDCHEBI:149492
ChEBI Name5,5-dimethyl-1-pyrroline
Stars
DefinitionA member of the class of pyrrolines that is 1-pyrroline in which the two hydrogens at position 5 are replaced by methyl groups.
Last Modified19 March 2021
SubmitterGareth Owen
DownloadsMolfile
FormulaC6H11N
Net Charge0
Average Mass97.161
Monoisotopic Mass97.08915
SMILESCC1(C)CCC=N1
InChIInChI=1S/C6H11N/c1-6(2)4-3-5-7-6/h5H,3-4H2,1-2H3
InChIKeyDVPIKQUDWCILSQ-UHFFFAOYSA-N
Roles Classification
Application:
spin trapping reagent  A reagent used in electron paramagnetic resonance (EPR) spectroscopy to react covalently with radical products whose half-life is be too short to detect. The resulting adducts are more stable enabling their paramagnetic resonance spectra to be obtained.
ChEBI Ontology
Outgoing Relation(s)
5,5-dimethyl-1-pyrroline (CHEBI:149492) has role spin trapping reagent (CHEBI:149497)
5,5-dimethyl-1-pyrroline (CHEBI:149492) is a pyrroline (CHEBI:23763)
Incoming Relation(s)
5,5-dimethyl-1-pyrroline N-oxide (CHEBI:149489) has functional parent 5,5-dimethyl-1-pyrroline (CHEBI:149492)
IUPAC Name 
2,2-dimethyl-3,4-dihydro-2H-pyrrole
Manual XrefsDatabases
9117576ChemSpider
Registry NumbersSources
CAS:2045-76-3ChEBI
Citations