ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003255
RECORD_TITLE: 2-METHYLTHIO-5-AMINOTHIAZOLO(5,4-D)PYRIMIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2-METHYLTHIO-5-AMINOTHIAZOLO(5,4-D)PYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H6N4S2
CH$EXACT_MASS: 198.00339
CH$SMILES: Nc(n2)nc(s1)c(c2)nc(SC)1
CH$IUPAC: InChI=1S/C6H6N4S2/c1-11-6-9-3-2-8-5(7)10-4(3)12-6/h2H,1H3,(H2,7,8,10)
CH$LINK: INCHIKEY AUXBHVTXXUIPHQ-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6E
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00kb-1900000000-fe3aff9b26a5d4da1425
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  83 6 60
  85 7 70
  97 14 140
  124 8 80
  125 7 70
  139 8 80
  165 89 890
  198 99.99 999
//
