ACCESSION: MSBNK-EPA-ENTACT_AGILENT001233
RECORD_TITLE: Kinetin; ESI-QTOF; MS2; CE: 40; [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 40

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$SPLASH: splash10-0f89-9000000000-9b83dcee19b340f0833e
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  44.049476 1.051827 10
  51.022927 1.51593 15
  53.038577 79.290626 792
  53.070939 2.63242 26
  54.046402 3.30946 33
  73.027063 1.658728 16
  81.033491 99.999999 999
  81.069877 3.884354 38
  81.077087 2.273767 22
  82.039974 5.574834 55
  119.035223 3.091074 30
//