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MassBank Record: KO003133

5-Hydroxylysine; LC-ESI-QQ; MS2; CE:10 V; [M+H]+

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: KO003133
RECORD_TITLE: 5-Hydroxylysine; LC-ESI-QQ; MS2; CE:10 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 10 V

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

PK$SPLASH: splash10-02t9-0900000000-584ff7fb97d914520ca5
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  19.400 14851.5 1
  38.700 14851.5 1
  54.900 64356.5 1
  56.900 19802.0 1
  59.000 99010.0 1
  71.200 163366.5 2
  73.000 178218.0 2
  74.000 133663.5 1
  77.100 108911.0 1
  81.100 34653.5 1
  82.300 623763.0 7
  84.000 113861.5 1
  86.400 108911.0 1
  89.000 69307.0 1
  89.900 148515.0 2
  90.800 44554.5 1
  98.800 920793.0 10
  100.100 1935645.5 21
  101.300 64356.5 1
  102.400 29703.0 1
  103.100 79208.0 1
  107.200 153465.5 2
  109.600 19802.0 1
  112.400 54455.5 1
  112.900 133663.5 1
  114.500 950496.0 10
  117.600 5183173.5 57
  118.000 91242665.5 999
  127.000 782179.0 9
  128.100 17841602.0 195
  130.800 168317.0 2
  145.100 25599035.5 280
  146.200 4460400.5 49
  163.400 87534741.0 958
//

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