ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010418
RECORD_TITLE: 1,3,4,5-TETRACHLORO-2,6-DICYANOBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA

CH$NAME: 1,3,4,5-TETRACHLORO-2,6-DICYANOBENZENE
CH$NAME: TPN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈Cl₄N₂
CH$EXACT_MASS: 263.88156
CH$SMILES: N#Cc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(C#N)1
CH$IUPAC: InChI=1S/C8Cl4N2/c9-5-3(1-13)6(10)8(12)7(11)4(5)2-14
CH$LINK: INCHIKEY CRQQGFGUEAVUIL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0020319

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$SPLASH: splash10-014i-0290000000-e11ada8b10c53d73e910
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  47 1.38 14
  62 1.99 20
  71 1.03 10
  74 1.96 20
  85 1.14 11
  86 1.7 17
  94 1.89 19
  96 1.12 11
  97 1.41 14
  98 4.08 41
  101 1.57 16
  102 1.79 18
  106 1.09 11
  109 9.57 96
  111 3.42 34
  118 1.42 14
  120 1.25 13
  124 9.63 96
  125 1.05 11
  132 4.48 45
  133 7.33 73
  134 3.32 33
  135 1.86 19
  144 1.71 17
  146 1.14 11
  159 3.12 31
  161 1.03 10
  168 6.32 63
  170 4.27 43
  179 1.21 12
  181 1.05 11
  194 5.93 59
  196 3.98 40
  203 2.28 23
  205 1.99 20
  229 11.01 110
  230 1.54 15
  231 11.52 115
  232 1.6 16
  233 3.2 32
  264 77.32 773
  266 99.99 999
  267 10.35 104
  268 48.96 490
  269 4.37 44
  270 11.39 114
  272 1.36 14
//