ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002035
RECORD_TITLE: 5-DIMETHYLAMINOPYRIMIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 5-DIMETHYLAMINOPYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₉N₃
CH$EXACT_MASS: 123.07965
CH$SMILES: CN(C)c(c1)cncn1
CH$IUPAC: InChI=1S/C6H9N3/c1-9(2)6-3-7-5-8-4-6/h3-5H,1-2H3
CH$LINK: INCHIKEY JWVNPUBYKCSIKR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60878929

AC$INSTRUMENT: MS-902
AC$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$SPLASH: splash10-00di-6900000000-3ada785e1607c944e5a3
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  39 1.6 16
  40 4.1 41
  40.5 1.6 16
  41 0.2 2
  42 16.6 166
  43 1.6 16
  44 1.7 17
  48 0.46 5
  51 3.1 31
  52 8.5 85
  53 6.1 61
  54 0.96 10
  55 1.1 11
  66 1.7 17
  67 4.6 46
  68 1.27 13
  69 10.6 106
  79 2.1 21
  80 2.9 29
  81 2.17 22
  82 1.8 18
  94 6.1 61
  95 6.7 67
  106 0.29 3
  107 4.3 43
  108 1 10
  122 99.99 999
  123 8.85 89
  124 7.5 75
//