MassBank Record: PR100490



 6-(gamma,gamma-Dimethylallylamino)purine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PR100490
RECORD_TITLE: 6-(gamma,gamma-Dimethylallylamino)purine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
DATE: 2016.01.19 (2010.06.21, 2011.05.06)
AUTHORS: Matsuda FPlant Science Center, RIKEN., Suzuki MPlant Science Center, RIKEN., Sawada YPlant Science Center, RIKEN., Plant Science Center, RIKEN.
LICENSE: CC BY-SA
COMMENT: Acquisition and generation of the data is financially supported in part by CREST/JST.

CH$NAME: 6-(gamma,gamma-Dimethylallylamino)purine CH$NAME: 2iP CH$NAME: N6-(2-Isopentenyl)adenine CH$NAME: Triacanthine CH$NAME: N6-Dimethylallyladenine CH$COMPOUND_CLASS: Imidazopyrimidines CH$FORMULA: C10H13N5 CH$EXACT_MASS: 203.11710 CH$SMILES: CC(C)=CCNC(=N2)C(N=1)C(N=C2)=NC1 CH$IUPAC: InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6,8H,4H2,1-2H3,(H,11,12,13,14,15) CH$LINK: CAS 2365-40-4 CH$LINK: CHEMSPIDER 83222 CH$LINK: KAPPAVIEW KPC00636 CH$LINK: KEGG C04083 CH$LINK: KNAPSACK C00000094 CH$LINK: PUBCHEM CID:92180 CH$LINK: INCHIKEY XVVUABVHOSCDJP-UHFFFAOYSA-N
AC$INSTRUMENT: UPLC Q-Tof Premier, Waters AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY Ramp 5-60 V AC$MASS_SPECTROMETRY: DATAFORMAT Continuum AC$MASS_SPECTROMETRY: DESOLVATION_GAS_FLOW 600.0 L/Hr AC$MASS_SPECTROMETRY: DESOLVATION_TEMPERATURE 400 C AC$MASS_SPECTROMETRY: FRAGMENTATION_METHOD LOW-ENERGY CID AC$MASS_SPECTROMETRY: IONIZATION ESI AC$MASS_SPECTROMETRY: SOURCE_TEMPERATURE 120 C AC$CHROMATOGRAPHY: CAPILLARY_VOLTAGE 3.0 kV AC$CHROMATOGRAPHY: SAMPLING_CONE 23.0 V AC$CHROMATOGRAPHY: SOLVENT CH3CN(0.1%HCOOH)/ H2O(0.1%HCOOH)
MS$FOCUSED_ION: PRECURSOR_M/Z 202.10929 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0f89-0930000000-c42cf9d026a5cc424879 PK$NUM_PEAK: 10 PK$PEAK: m/z int. rel.int. 106.0283 54.22 67 107.0365 84.36 104 117.0200 61.44 76 132.0315 200.5 248 133.0388 615.9 762 134.0466 807.2 999 164.8366 616 762 166.8334 206.8 256 201.8021 324.1 401 202.1093 670 829 //