ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002017
RECORD_TITLE: 1-PHENYLPYRAZOLE; 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$NAME: 1-PHENYLPYRAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₈N₂
CH$EXACT_MASS: 144.06875
CH$SMILES: c(c2)ccc(c2)n(c1)ncc1
CH$IUPAC: InChI=1S/C9H8N2/c1-2-5-9(6-3-1)11-8-4-7-10-11/h1-8H
CH$LINK: INCHIKEY WITMXBRCQWOZPX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30150108

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$SPLASH: splash10-0006-8900000000-4c578db5e103b13c297e
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  26 1.5 15
  27 3 30
  28 3.4 34
  37 0.12 1
  38 3.8 38
  39 8.2 82
  40 1.9 19
  41 0.26 3
  50 6.5 65
  51 26.5 265
  52 4.9 49
  58.5 0.11 1
  62 1.9 19
  63 6.7 67
  64 5.6 56
  65 0.36 4
  66 1.8 18
  72 3 30
  74 1.9 19
  75 0.2 2
  76 2.1 21
  77 40.9 409
  78 4.3 43
  89 0.82 8
  90 21.5 215
  91 5.9 59
  104 6.3 63
  115 0.67 7
  116 7.1 71
  117 20.8 208
  118 13.1 131
  119 0.11 1
  142 1.8 18
  143 13.4 134
  144 99.99 999
  145 11 110
//