ACCESSION: MSBNK-RIKEN_ReSpect-PT102400
RECORD_TITLE: 6-Hydroxy-2-aminopurine, 2-amino-3,7-dihydropurin-6-one, 2-Amino-6-hydroxypurine, Guanine, 2-Aminohypoxanthine, 2-Amino-6-oxypurine, Guanine enol; LC-ESI-QTOF; MS2
DATE: 2008.07.25
AUTHORS: Matsuda F, Suzuki M, Sawada Y, Plant Science Center, RIKEN.
LICENSE: CC BY-NC
COPYRIGHT: Copyright(C) 2009 Plant Science Center, RIKEN
COMMENT: Build 1 2009/06/24
COMMENT: Acquisition and generation of the data is financially supported in part by CREST/JST.

CH$NAME: 6-Hydroxy-2-aminopurine
CH$NAME: 2-amino-3,7-dihydropurin-6-one
CH$NAME: 2-Amino-6-hydroxypurine
CH$NAME: Guanine
CH$NAME: 2-Aminohypoxanthine
CH$NAME: 2-Amino-6-oxypurine
CH$NAME: Guanine enol
CH$COMPOUND_CLASS: CLASS1 Other CLASS2 Other CLASS3 Guanine
CH$FORMULA: C₅H₅N₅O
CH$EXACT_MASS: 151.129
CH$SMILES: C1=NC2=C(N1)C(=O)N=C(N2)N
CH$IUPAC: InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)
CH$LINK: CAS 73-40-5
CH$LINK: INCHIKEY UYTPUPDQBNUYGX-UHFFFAOYSA-N

AC$INSTRUMENT: Q-Tof Premier, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY Ramp 5-45 V
AC$MASS_SPECTROMETRY: CAPILLARY_VOLTAGE 3.0 kV
AC$CHROMATOGRAPHY: SOLVENT CH3CN/H2O

MS$FOCUSED_ION: ION_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 152.05721

PK$SPLASH: splash10-0udi-0900000000-422f992621ab9626d1b2
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  111.0206 25.78 120
  131.5321 23.01 107
  152.0572 214.4 999
//