ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004357
RECORD_TITLE: 1,5-DIPHENYLPYRAZOLE; 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$NAME: 1,5-DIPHENYLPYRAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₂N₂
CH$EXACT_MASS: 220.10005
CH$SMILES: [H]c(n1)c([H])c(c(c3)cccc3)n1c(c2)cccc2
CH$IUPAC: InChI=1S/C15H12N2/c1-3-7-13(8-4-1)15-11-12-16-17(15)14-9-5-2-6-10-14/h1-12H
CH$LINK: INCHIKEY IDCXLYCLPHRSAZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60346572

AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00xr-3290000000-4854a283ad7ec16947bd
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
  27 1.5 15
  28 3.3 33
  39 2.8 28
  40 0.05 1
  41 1 10
  50 1.8 18
  51 11.4 114
  52 0.16 2
  53 5.4 54
  64 2.9 29
  65 2.4 24
  75 0.15 2
  76 2.6 26
  77 20.8 208
  78 1.9 19
  89 0.69 7
  90 4.9 49
  91 2.8 28
  95.5 2.2 22
  96 0.08 1
  96.5 1.6 16
  102 2 20
  103 1.4 14
  104 0.22 2
  109 1.5 15
  109.5 2.6 26
  110 1.7 17
  115 0.33 3
  116 3.2 32
  117 3 30
  151 1.4 14
  152 0.23 2
  163 1.2 12
  164 1.6 16
  165 9.7 97
  166 0.22 2
  177 1.3 13
  178 1.9 19
  179 0.9 9
  180 0.25 3
  190 4.2 42
  191 4.7 47
  192 13.7 137
  193 0.47 5
  194 1.1 11
  205 1.8 18
  217 1.4 14
  218 0.83 8
  219 76 760
  220 99.99 999
  221 17.3 173
  222 1.4 14
//