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MassBank Record: PT102410

9-(beta-D-Ribofuranosyl)guanine, Guanine Riboside, GR, Vernine, 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one, Guanidine, Guanosine, Guanine-9-beta-D-ribofuranoside; LC-ESI-QTOF; MS2

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

ACCESSION: PT102410
RECORD_TITLE: 9-(beta-D-Ribofuranosyl)guanine, Guanine Riboside, GR, Vernine, 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one, Guanidine, Guanosine, Guanine-9-beta-D-ribofuranoside; 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$NAME: 9-(beta-D-Ribofuranosyl)guanine
CH$NAME: Guanine Riboside
CH$NAME: GR
CH$NAME: Vernine
CH$NAME: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
CH$NAME: Guanidine
CH$NAME: Guanosine
CH$NAME: Guanine-9-beta-D-ribofuranoside
CH$COMPOUND_CLASS: CLASS1 Other CLASS2 Nucleoside CLASS3 Guanosine
CH$FORMULA: C10H13N5O5
CH$EXACT_MASS: 283.244
CH$SMILES: C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=O)N
CH$IUPAC: InChI=1S/C10H13N5O5/c11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)
CH$LINK: CAS 118-00-3
CH$LINK: INCHIKEY NYHBQMYGNKIUIF-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 284.09946

PK$SPLASH: splash10-0f89-0590000000-12615cea517dfdcb46c9
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  152.0585 375.1 646
  283.9827 19.14 33
  284.0995 579.8 999
//

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