ACCESSION: MSBNK-EPA-ENTACT_AGILENT001232
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 NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 214.0734334947
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-3900000000-859f085ed5016ebb0e9d
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  41.014522 2.831659 28
  53.014522 1.149726 11
  64.006697 5.333566 53
  65.014522 8.872757 88
  66.009771 42.283325 422
  66.034923 1.020696 10
  67.017596 1.411878 14
  68.025421 1.906226 19
  69.034588 1.300719 12
  78.009771 1.233402 12
  79.017596 13.202937 131
  90.009771 11.530658 115
  91.017596 1.50614 15
  92.025421 16.862006 168
  105.02067 3.730336 37
  106.028495 30.174907 301
  107.03632 29.622173 295
  108.032911 1.149241 11
  117.02067 32.106368 320
  118.028495 3.80803 38
  119.03632 2.32634 23
  132.031569 100 999
  133.039394 72.518533 724
  134.047219 29.891076 298
  135.055044 2.07907 20
  142.041071 1.570477 15
  144.031569 4.057965 40
  146.047219 1.329565 13
  184.062869 1.350093 13
//