MassBank Record: KO004246

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

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

ACCESSION: KO004246
RECORD_TITLE: Uridine; 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 U006

CH$NAME: Uridine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H12N2O6
CH$EXACT_MASS: 244.06954
CH$SMILES: OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1N(C=2)C(=O)NC(=O)C2
CH$IUPAC: InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1
CH$LINK: CAS 58-96-8
CH$LINK: CHEBI 16704
CH$LINK: COMPTOX DTXSID40891555
CH$LINK: INCHIKEY DRTQHJPVMGBUCF-XVFCMESISA-N
CH$LINK: KEGG C00299
CH$LINK: NIKKAJI J4.593D
CH$LINK: PUBCHEM SID:3593

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$FOCUSED_ION: PRECURSOR_M/Z 245
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-03dj-3960000000-3466ccfdf88139ddf140
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  80.8 113862.0 17.0
  85.2 19802.0 3.0
  92.1 3103960.0 454.0
  96.0 34653.5 5.0
  97.1 24752.5 4.0
  105.3 69307.0 10.0
  113.0 6836640.0 999.0
  115.4 39604.0 6.0
  121.2 24752.5 4.0
  125.2 19802.0 3.0
  133.2 143564.0 21.0
  136.5 24752.5 4.0
  138.9 24752.5 4.0
  141.4 74257.5 11.0
  148.9 34653.5 5.0
  153.0 44554.5 7.0
  154.1 381188.0 56.0
  155.3 103960.0 15.0
  155.9 49505.0 7.0
  156.7 24752.5 4.0
  163.2 34653.5 5.0
  168.5 29703.0 4.0
  172.7 19802.0 3.0
  177.1 34653.5 5.0
  180.9 207921.0 30.0
  185.2 39604.0 6.0
  186.8 44554.5 7.0
  192.2 391090.0 57.0
  196.1 14851.5 2.0
  209.1 158416.0 23.0
  210.0 198020.0 29.0
  213.4 198020.0 29.0
  227.1 163366.0 24.0
  228.5 1475250.0 216.0
  231.3 94059.5 14.0
  245.2 4084160.0 597.0
  263.2 19802.0 3.0
//