MassBank Record: KNA00258



 L-(+)-Lysine; LC-ESI-ITFT; MS2; m/z:147.11; POS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KNA00258
RECORD_TITLE: L-(+)-Lysine; LC-ESI-ITFT; MS2; m/z:147.11; POS
DATE: 2016.01.19 (2009.11.17, 2011.08.03)
AUTHORS: Takahashi HGraduate School of Information Science, NAIST, Kanaya SGraduate School of Information Science, NAIST, Ogasawara NGraduate School of Information Science, NAIST, Graduate School of Information Science, NAIST
LICENSE: CC BY-SA

CH$NAME: L-Lysine CH$NAME: Lysine acid CH$NAME: 2,6-Diaminohexanoic acid CH$NAME: L-(+)-Lysine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H14N2O2 CH$EXACT_MASS: 146.10553 CH$SMILES: NCCCC[C@H](N)C(O)=O CH$IUPAC: InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1 CH$LINK: CAS 56-87-1 CH$LINK: CHEBI 18019 CH$LINK: KEGG C00047 CH$LINK: KNAPSACK C00001378 CH$LINK: NIKKAJI J9.176F CH$LINK: PUBCHEM 3349 CH$LINK: INCHIKEY KDXKERNSBIXSRK-YFKPBYRVSA-N
AC$INSTRUMENT: LTQ Orbitrap XL, Thermo Scientfic AC$INSTRUMENT_TYPE: LC-ESI-ITFT AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 35eV AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: COLUMN_NAME TOSOH TSKgel ODS-100V 5um Part no. 21456 AC$CHROMATOGRAPHY: FLOW_GRADIENT 0min:3%, 45min:97%, 50min:97%, 50.1:3%, 57min:3% (acetonitrile) AC$CHROMATOGRAPHY: FLOW_RATE 0.5 ml/min AC$CHROMATOGRAPHY: RETENTION_TIME 3.955927 min AC$CHROMATOGRAPHY: SOLVENT 0.1%formate-water / 0.1%formate-acetonitrile
MS$FOCUSED_ION: BASE_PEAK 130.013702 MS$FOCUSED_ION: PRECURSOR_M/Z 147.11
PK$SPLASH: splash10-001i-0900000000-41e1a6499097748934b0 PK$NUM_PEAK: 4 PK$PEAK: m/z int. rel.int. 83.982239 41238.457031 42 101.062607 2230.833496 2 129.402756 150831.906250 155 130.013702 973960.062500 999 //