MassBank Record: KO002312



 5-Aminopentanoic acid; LC-ESI-QQ; MS2; CE:50 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002312
RECORD_TITLE: 5-Aminopentanoic acid; LC-ESI-QQ; MS2; CE:50 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 A135

CH$NAME: 5-Aminopentanoate CH$NAME: 5-Aminovaleric acid CH$NAME: 5-Aminopentanoic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H11NO2 CH$EXACT_MASS: 117.07898 CH$SMILES: NCCCCC(O)=O CH$IUPAC: InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8) CH$LINK: CAS 660-88-8 CH$LINK: CHEBI 15887 CH$LINK: KEGG C00431 CH$LINK: NIKKAJI J38.132B CH$LINK: PUBCHEM SID:3720
AC$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 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 118 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4i-9000000000-3f1c0f186d2397481f21 PK$NUM_PEAK: 10 PK$PEAK: m/z int. rel.int. 29.100 49505.0 49 39.200 94059.5 93 41.000 153465.5 152 42.900 103960.5 103 43.900 59406.0 59 44.800 163366.5 162 53.100 133663.5 132 55.200 1009902.0 999 55.900 396040.0 392 59.300 138614.0 137 //