ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001636
RECORD_TITLE: QUINOXALINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: QUINOXALINE
CH$NAME: QUINAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₆N₂
CH$EXACT_MASS: 130.05310
CH$SMILES: c(c2)cc(n1)c(c2)ncc1
CH$IUPAC: InChI=1S/C8H6N2/c1-2-4-8-7(3-1)9-5-6-10-8/h1-6H
CH$LINK: CAS 91-19-0
CH$LINK: INCHIKEY XSCHRSMBECNVNS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6049432

AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-0ugi-9500000000-c4b7c01a403433740bfe
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  32 10.88 109
  37 9.73 97
  38 12.48 125
  39 6.87 69
  40 1.83 18
  44 30.92 309
  49 4.81 48
  50 64.49 645
  51 26.57 266
  52 15.92 159
  53 3.32 33
  61 1.83 18
  62 2.52 25
  63 4.12 41
  64 5.49 55
  65 11.79 118
  73 1.26 13
  74 10.53 105
  75 20.84 208
  76 97.36 974
  77 10.76 108
  78 1.83 18
  80 1.71 17
  102 7.33 73
  103 80.98 810
  104 6.41 64
  128 1.03 10
  129 7.21 72
  130 99.99 999
  131 10.3 103
//