ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010429
RECORD_TITLE: PHOSPHOROTHIOIC ACID O,O-DIETHYL O-(6-METHYL-2-(1-METHYLETHYL)-4-PYRIMIDINYL) ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA

CH$NAME: PHOSPHOROTHIOIC ACID O,O-DIETHYL O-(6-METHYL-2-(1-METHYLETHYL)-4-PYRIMIDINYL) ESTER
CH$NAME: DIAZINON
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₁N₂O₃PS
CH$EXACT_MASS: 304.10105
CH$SMILES: CCOP(=S)(OCC)Oc(c1)nc(C(C)C)nc(C)1
CH$IUPAC: InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3
CH$LINK: INCHIKEY FHIVAFMUCKRCQO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9020407

AC$INSTRUMENT: JEOL JMS-DX-303
AC$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$SPLASH: splash10-0ufr-3931000000-a70584cb463b92093849
PK$NUM_PEAK: 100
PK$PEAK: m/z int. rel.int.
  39 6.7 67
  41 11.23 112
  42 9.91 99
  43 13.67 137
  45 1.87 19
  47 2.12 21
  52 2.98 30
  53 1.3 13
  54 8.58 86
  55 2.72 27
  65 10.74 107
  66 19.17 192
  67 6.21 62
  68 8.33 83
  69 1.77 18
  70 2.75 28
  80 1.1 11
  81 2.36 24
  82 2.1 21
  83 2.53 25
  84 14.88 149
  93 34.58 346
  94 3.35 34
  96 1.06 11
  97 22.36 224
  98 2.27 23
  99 1.82 18
  100 1.57 16
  108 1.29 13
  109 4.16 42
  110 3.86 39
  111 1.2 12
  114 1.54 15
  115 1.15 12
  119 4.71 47
  121 3.55 36
  124 21.21 212
  125 7.6 76
  126 1.76 18
  133 3.3 33
  134 8.44 84
  135 25.89 259
  136 3.69 37
  137 89.55 896
  138 7.86 79
  140 1.58 16
  147 2.77 28
  149 1.53 15
  150 1.16 12
  151 23.29 233
  152 84.47 845
  153 41.09 411
  154 3.86 39
  155 1.02 10
  161 1.45 15
  162 15.44 154
  163 17.85 179
  164 5.64 56
  165 2.27 23
  167 8.53 85
  168 4.24 42
  179 99.99 999
  180 14.16 142
  181 1.57 16
  183 3.16 32
  195 4.95 50
  196 1.03 10
  197 1.51 15
  199 49.78 498
  200 5.08 51
  215 12.46 125
  216 16.17 162
  217 2.3 23
  220 1.54 15
  227 26.48 265
  228 3.37 34
  231 10.28 103
  232 2.97 30
  233 5.66 57
  243 3.72 37
  247 4.76 48
  248 26.56 266
  249 2.97 30
  250 1.71 17
  259 5.23 52
  260 12.93 129
  261 5.26 53
  262 1.25 13
  272 1.12 11
  273 2.95 30
  276 28.22 282
  277 3.9 39
  278 1.77 18
  288 1.38 14
  289 11 110
  290 2.11 21
  303 1.8 18
  304 68.48 685
  305 10.85 109
  306 4.18 42
//