ACCESSION: MSBNK-Keio_Univ-KO003285
RECORD_TITLE: L-(+)-Lysine; 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 L004

CH$NAME: Lys
CH$NAME: L-Lysine
CH$NAME: Lysine acid
CH$NAME: 2,6-Diaminohexanoic acid
CH$NAME: L-(+)-Lysine
CH$COMPOUND_CLASS: N/A
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: NIKKAJI J9.176F
CH$LINK: PUBCHEM SID:3349
CH$LINK: INCHIKEY KDXKERNSBIXSRK-YFKPBYRVSA-N
CH$LINK: COMPTOX DTXSID6023232

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$FOCUSED_ION: PRECURSOR_M/Z 147
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-001i-9000000000-5b06b6e9dcf9faf8e89c
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  41.200 113861.5 8
  42.900 44554.5 3
  55.300 396040.0 28
  56.200 2282180.5 164
  64.900 123762.5 9
  67.000 1371288.5 99
  69.200 440594.5 32
  69.900 29703.0 2
  73.900 79208.0 6
  77.000 29703.0 2
  77.800 34653.5 2
  81.900 153465.5 11
  82.500 44554.5 3
  84.200 13896053.5 999
  95.100 19802.0 1
  102.900 19802.0 1
//