MassBank Record: KO002361



 2-Amino-2-methylbutanoic acid; LC-ESI-QQ; MS2; CE:40 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002361
RECORD_TITLE: 2-Amino-2-methylbutanoic acid; LC-ESI-QQ; MS2; CE:40 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 A189

CH$NAME: 2-Amino-2-methylbutanoate CH$NAME: 2-Amino-2-methylbutanoic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H11NO2 CH$EXACT_MASS: 117.07898 CH$SMILES: CCC(C)(N)C(O)=O CH$IUPAC: InChI=1S/C5H11NO2/c1-3-5(2,6)4(7)8/h3,6H2,1-2H3,(H,7,8) CH$LINK: KEGG C03571 CH$LINK: PUBCHEM SID:6363
AC$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 40 V
MS$FOCUSED_ION: PRECURSOR_M/Z 118 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0ab9-9000000000-b4358de5e79d4fbd9abe PK$NUM_PEAK: 12 PK$PEAK: m/z int. rel.int. 40.800 34653.5 28 44.400 54455.5 44 45.100 188119.0 154 53.200 49505.0 40 55.100 1222773.5 999 57.100 628713.5 514 58.000 64356.5 53 71.000 34653.5 28 72.200 970298.0 793 83.000 34653.5 28 99.600 9901.0 8 451.700 19802.0 16 //