ACCESSION: MSBNK-Keio_Univ-KO003137
RECORD_TITLE: 5-Hydroxylysine; 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 H064

CH$NAME: 5-Hydroxylysine
CH$NAME: 5-Hydroxy-L-lysine
CH$NAME: Procollagen 5-hydroxy-L-lysine
CH$NAME: Procollagen L-erythro-5-hydroxy-L-lysine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄N₂O₃
CH$EXACT_MASS: 162.10044
CH$SMILES: NCC(O)CC[C@H](N)C(O)=O
CH$IUPAC: InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)/t4?,5-/m0/s1
CH$LINK: CAS 1190-94-9
CH$LINK: CHEBI 18040
CH$LINK: KEGG C01211
CH$LINK: NIKKAJI J38.540I
CH$LINK: PUBCHEM SID:4433
CH$LINK: INCHIKEY YSMODUONRAFBET-AKGZTFGVSA-N

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$FOCUSED_ION: PRECURSOR_M/Z 163
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-0a4i-9000000000-23fa57c48ecab77190a8
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  41.000 74257.5 12
  43.700 64356.5 10
  46.000 262376.5 41
  53.300 108911.0 17
  54.000 49505.0 8
  55.100 2663369.0 418
  56.300 2381190.5 373
  57.100 64356.5 10
  58.300 6371293.5 999
  59.200 1732675.0 272
  65.200 153465.5 24
  66.900 386139.0 61
  68.300 74257.5 12
  69.100 94059.5 15
  70.000 123762.5 19
  74.100 173267.5 27
  76.600 34653.5 5
  80.300 148515.0 23
  82.200 485149.0 76
  84.100 89109.0 14
  117.300 49505.0 8
  118.000 118812.0 19
  127.800 64356.5 10
//