MassBank Record: KO002664



 N,N-Dimethylglycine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002664
RECORD_TITLE: N,N-Dimethylglycine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID D036

CH$NAME: N,N-Dimethylglycine CH$NAME: Dimethylglycine CH$COMPOUND_CLASS: N/A CH$FORMULA: C4H9NO2 CH$EXACT_MASS: 103.06333 CH$SMILES: CN(C)CC(O)=O CH$IUPAC: InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7) CH$LINK: CAS 1118-68-9 CH$LINK: CHEBI 17724 CH$LINK: CHEMPDB DMG CH$LINK: KEGG C01026 CH$LINK: NIKKAJI J135.420E CH$LINK: PUBCHEM SID:4271
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 104 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4i-9000000000-9c9075d302e11b82ee64 PK$NUM_PEAK: 12 PK$PEAK: m/z int. rel.int. 40.900 133663.5 5 42.200 108911.0 4 43.100 158416.0 6 43.900 326733.0 12 45.200 138614.0 5 55.300 14851.5 1 56.300 143564.5 5 56.500 44554.5 2 58.300 27747552.5 999 69.200 995050.5 36 86.200 6643571.0 239 104.000 69307.0 2 //