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MassBank Record: KO002943

Guanosine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+

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

ACCESSION: KO002943
RECORD_TITLE: Guanosine; LC-ESI-QQ; MS2; CE:50 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 G015

CH$NAME: Guanosine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H13N5O5
CH$EXACT_MASS: 283.091669
CH$SMILES: C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(NC2=O)N
CH$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)/t3-,5-,6-,9-/m1/s1
CH$LINK: CAS 118-00-3
CH$LINK: CHEBI 16750
CH$LINK: CHEMSPIDER 6544
CH$LINK: COMPTOX DTXSID00893055
CH$LINK: INCHIKEY NYHBQMYGNKIUIF-UUOKFMHZSA-N
CH$LINK: KAPPAVIEW KPC00589
CH$LINK: KEGG C00387
CH$LINK: KNAPSACK C00019679
CH$LINK: NIKKAJI J10.076E
CH$LINK: PUBCHEM CID:135398635

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 50 V

MS$FOCUSED_ION: PRECURSOR_M/Z 284
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-0f79-0900000000-4ed5ef88e022858add62
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  42.800 89109.0 7
  44.900 39604.0 3
  55.400 198020.0 16
  57.100 341584.5 27
  58.800 39604.0 3
  61.100 84158.5 7
  69.100 193069.5 15
  70.900 217822.0 17
  73.100 178218.0 14
  79.900 44554.5 4
  82.200 128713.0 10
  85.000 99010.0 8
  98.000 44554.5 4
  98.900 54455.5 4
  102.600 34653.5 3
  104.800 29703.0 2
  107.100 232673.5 19
  109.000 440594.5 35
  110.100 4158420.0 332
  115.200 29703.0 2
  128.000 64356.5 5
  134.400 420792.5 34
  135.300 12495062.0 999
  150.200 19802.0 2
  151.000 34653.5 3
  152.300 7752483.0 620
  153.100 628713.5 50
//

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