ACCESSION: MSBNK-EPA-ENTACT_AGILENT001234
RECORD_TITLE: Kinetin; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Kinetin
CH$NAME: DTXSID9035175
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₉N₅O
CH$EXACT_MASS: 215.0807099464
CH$SMILES: C(NC1NC=NC2=NC=NC2=1)C1=CC=CO1
CH$IUPAC: InChI=1S/C10H9N5O/c1-2-7(16-3-1)4-11-9-8-10(13-5-12-8)15-6-14-9/h1-3,5-6H,4H2,(H2,11,12,13,14,15)
CH$LINK: CAS 525-79-1
CH$LINK: INCHIKEY QANMHLXAZMSUEX-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:3830

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 216.0879863981
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-9100000000-643c26b0b0228bee68f0
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  53.038577 4.962622 49
  81.033491 99.999996 999
  81.069877 4.381768 43
  81.077087 2.295321 22
  82.039974 5.182381 51
  130.084912 2.508003 25
  136.061772 1.436966 14
  148.061772 6.657461 66
  188.093072 2.542879 25
  216.087986 3.884287 38
//