MassBank Record: KO002889

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

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

ACCESSION: KO002889
RECORD_TITLE: 6-Furfurylaminopurine; 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 F014

CH$NAME: 6-Furfurylaminopurine
CH$NAME: 6-Furfuryladenine
CH$NAME: Kinetin
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H9N5O
CH$EXACT_MASS: 215.08071
CH$SMILES: C1=COC(=C1)CNC2=NC=NC3=C2NC=N3
CH$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: COMPTOX DTXSID9035175
CH$LINK: INCHIKEY QANMHLXAZMSUEX-UHFFFAOYSA-N
CH$LINK: KEGG C08272
CH$LINK: NIKKAJI J6.656G
CH$LINK: PUBCHEM SID:10471

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$FOCUSED_ION: PRECURSOR_M/Z 216
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-014i-0090000000-39566aaa0d90cfa55b52
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  54.2 183168.0 2.0
  72.0 202970.0 2.0
  74.0 19802.0 1.0
  80.8 262376.0 3.0
  87.3 29703.0 1.0
  91.1 123762.0 1.0
  96.5 19802.0 1.0
  99.3 69307.0 1.0
  100.7 19802.0 1.0
  104.6 24752.5 1.0
  107.2 24752.5 1.0
  107.4 19802.0 1.0
  109.2 24752.5 1.0
  111.0 99010.0 1.0
  112.7 24752.5 1.0
  116.3 19802.0 1.0
  125.0 44554.5 1.0
  128.9 9901.0 1.0
  135.4 39604.0 1.0
  139.0 232674.0 3.0
  140.9 24752.5 1.0
  143.0 39604.0 1.0
  148.2 1049510.0 12.0
  152.9 34653.5 1.0
  153.9 84158.5 1.0
  156.3 69307.0 1.0
  157.1 54455.5 1.0
  158.0 9901.0 1.0
  161.3 29703.0 1.0
  167.1 44554.5 1.0
  169.3 89109.0 1.0
  173.4 34653.5 1.0
  175.0 59406.0 1.0
  181.1 257426.0 3.0
  184.0 202970.0 2.0
  188.3 163366.0 2.0
  198.3 108911.0 1.0
  199.3 5876240.0 65.0
  216.2 9.05298E7 999.0
  217.3 24752.5 1.0
//