MassBank Record: KO009308

Home Search Record Index

Uridine; LC-ESI-IT; MS3; m/z: 245/113; [M+H]+

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

ACCESSION: KO009308
RECORD_TITLE: Uridine; LC-ESI-IT; MS3; m/z: 245/113; [M+H]+
DATE: 2011.12.05 (Created 2008.05.12)
AUTHORS: Ojima Y, Kakazu Y, Horai H, Soga T, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID U006
COMMENT: [MS2] KO009307

CH$NAME: Uridine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H12N2O6
CH$EXACT_MASS: 244.069539999999989277057466097176074981689453125
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$INSTRUMENT: LC/MSD Trap XCT, Agilent Technologies
AC$INSTRUMENT_TYPE: LC-ESI-IT
AC$MASS_SPECTROMETRY: MS_TYPE MS3
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 0.50/0.50

MS$FOCUSED_ION: PRECURSOR_M/Z 245/113
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE LC/MSD Trap Control and Data Analysis

PK$SPLASH: splash10-03di-5900000000-69944d9ce81849ec71c6
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  71.1 8.09 155
  95.1 7.19 137
  96.0 15.14 289
  113.1 52.27 999
//