MassBank Record: KO002890

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6-Furfurylaminopurine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

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

ACCESSION: KO002890
RECORD_TITLE: 6-Furfurylaminopurine; LC-ESI-QQ; MS2; CE:20 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 20 V

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

PK$SPLASH: splash10-00lr-9470000000-5aff4f962e7ab520661d
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  56.9 24752.5 1.0
  69.2 89109.0 4.0
  70.9 74257.5 4.0
  81.0 2.08515E7 999.0
  83.0 222772.0 11.0
  85.0 54455.5 3.0
  91.2 217822.0 10.0
  95.2 74257.5 4.0
  97.2 148515.0 7.0
  98.9 69307.0 3.0
  104.9 351486.0 17.0
  106.8 54455.5 3.0
  110.4 29703.0 1.0
  111.2 113862.0 5.0
  112.3 19802.0 1.0
  113.9 19802.0 1.0
  120.9 39604.0 2.0
  123.3 133664.0 6.0
  125.2 39604.0 2.0
  128.8 19802.0 1.0
  129.2 19802.0 1.0
  131.3 9901.0 1.0
  135.2 108911.0 5.0
  136.3 321782.0 15.0
  137.8 44554.5 2.0
  138.9 94059.5 5.0
  142.9 59406.0 3.0
  145.0 29703.0 1.0
  148.1 4945550.0 237.0
  153.7 14851.5 1.0
  157.2 168317.0 8.0
  162.9 54455.5 3.0
  163.3 163366.0 8.0
  169.1 24752.5 1.0
  171.2 178218.0 9.0
  173.2 420792.0 20.0
  181.2 267327.0 13.0
  188.4 1163370.0 56.0
  198.0 163366.0 8.0
  199.5 1341590.0 64.0
  216.2 1.89109E7 906.0
//