ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002039
RECORD_TITLE: 5-CHLORO-2-METHOXYPYRIMIDINE; 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$NAME: 5-CHLORO-2-METHOXYPYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₅ClN₂O
CH$EXACT_MASS: 144.00904
CH$SMILES: COc(n1)ncc(Cl)c1
CH$IUPAC: InChI=1S/C5H5ClN2O/c1-9-5-7-2-4(6)3-8-5/h2-3H,1H3
CH$LINK: INCHIKEY GJNGJHZIOYFEOP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID80191728

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$SPLASH: splash10-0296-5900000000-7b2caffd467d54d3a435
PK$NUM_PEAK: 45
PK$PEAK: m/z int. rel.int.
  38 4.1 41
  39 5.9 59
  40 1.1 11
  42 0.91 9
  43 2.1 21
  49 1.8 18
  50 7.8 78
  51 0.98 10
  52 15.5 155
  53 9 90
  54 7.9 79
  56 0.1 1
  60 9.8 98
  61 1.9 19
  62 3.8 38
  65 0.14 1
  67 2.1 21
  73 4.3 43
  74 20.9 209
  75 0.17 2
  76 6.9 69
  77 3.1 31
  79 6.7 67
  81 0.25 3
  82 17.8 178
  86 5.5 55
  87 34.5 345
  88 0.34 3
  89 11.4 114
  90 2.4 24
  102 8.6 86
  104 0.26 3
  109 1.2 12
  110 1.3 13
  113 4 40
  114 99.99 999
  115 35.3 353
  116 34.5 345
  117 12.8 128
  118 0.14 1
  143 25.9 259
  144 81.9 819
  145 14.3 143
  146 2.88 29
  147 1.8 18
//