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Trimethylaminoacetone

PropertiesImage
MNX_IDMNXM13161 Image of MNXM13161
referencechebi:166498
formulaC6H14NO
global charge1
mol weight116.184
InChIKeyLFWNPKYGVKNNAB-UHFFFAOYSA-N
InChIInChI=1S/C6H14NO/c1-6(8)5-7(2,3)4/h5H2,1-4H3/q+1
SMILESCC(=O)C[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C6H14NO/c1-6(8)5-7(2,3)4/h5H2,1-4H3/q+1 Image of MNXM13161
SMILES (mnx)[CH3:1][C:6]([CH2:5][N+:7]([CH3:2])([CH3:3])[CH3:4])=[O:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:166498
chebi:166498
LFWNPKYGVKNNAB-UHFFFAOYSA-N 		Trimethylaminoacetone
trimethyl(2-oxopropyl)azanium
hmdb:HMDB0012296
LFWNPKYGVKNNAB-UHFFFAOYSA-N 		Trimethylaminoacetone
(2-Oxopropyl)trimethylammonium
Acetonyltrimethylammonium
Acetonyltrimethylammonium hydroxide
N,N,N-Trimethyl-2-oxo-1-propanaminium
trimethyl(2-oxopropyl)azanium

metacyc.compound:CPD-5621
metacycM:CPD-5621
seed.compound:cpd24583
seedM:cpd24583
LFWNPKYGVKNNAB-UHFFFAOYSA-N 		trimethylaminoacetone

hmdb:HMDB12296
seedM:M_cpd24583 		secondary/obsolete/fantasy identifier