ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011192
RECORD_TITLE: N-(3-TRIFLUOROMETHYLBENZYLIDENE)METHYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SAWADA M, THE INST. OF SCIENTIFIC AND INDUSTRIALRESEARCH OSAKA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: N-(3-TRIFLUOROMETHYLBENZYLIDENE)METHYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₈F₃N
CH$EXACT_MASS: 187.06088
CH$SMILES: CN=Cc(c1)cc(cc1)C(F)(F)F
CH$IUPAC: InChI=1S/C9H8F3N/c1-13-6-7-3-2-4-8(5-7)9(10,11)12/h2-6H,1H3/b13-6+
CH$LINK: INCHIKEY PYFNALSBVCFOLS-AWNIVKPZSA-N

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-00ku-7900000000-525e555fdbb005f503ab
PK$NUM_PEAK: 86
PK$PEAK: m/z int. rel.int.
  33 1.6 16
  37 2 20
  38 8.1 81
  39 16.2 162
  40 6.7 67
  41 29.5 295
  42 70.3 703
  43 5.7 57
  49 1.1 11
  50 22 220
  51 18.5 185
  52 3 30
  57 5.7 57
  61 2.7 27
  62 9.8 98
  63 18 180
  64 3.2 32
  65 2.3 23
  66 1.4 14
  68 1.1 11
  69 56.9 569
  70 1.8 18
  74 8.6 86
  75 23.9 239
  76 10.3 103
  77 6.5 65
  80 1 10
  81 3.3 33
  83 1.9 19
  86 2.9 29
  87 5.2 52
  88 4.2 42
  89 13.9 139
  90 5.8 58
  91 7 70
  93 1.1 11
  94 1.9 19
  95 12.2 122
  96 5.1 51
  99 5.8 58
  100 2.7 27
  101 2.1 21
  102 3.6 36
  107 7.3 73
  108 3 30
  109 12.2 122
  110 1.2 12
  112 1 10
  114 1.3 13
  116 3 30
  117 8.2 82
  118 22.8 228
  119 8.7 87
  120 1.2 12
  121 5 50
  125 12.3 123
  126 7.4 74
  127 4.8 48
  132 1.3 13
  137 1.4 14
  138 3.8 38
  139 1.8 18
  143 1 10
  144 1.3 13
  145 37.8 378
  146 7.9 79
  152 8.9 89
  153 1.2 12
  155 1 10
  157 1.3 13
  158 3 30
  159 21 210
  160 2 20
  166 3.5 35
  167 1.5 15
  168 22 220
  169 2.6 26
  170 3 30
  171 5 50
  172 1.9 19
  173 3.6 36
  174 2.8 28
  185 3.6 36
  186 99.99 999
  187 95.5 955
  188 19.7 197
//