ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009512
RECORD_TITLE: 9-ANTHRACENECARBONITRILE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: 9-ANTHRACENECARBONITRILE
CH$NAME: 9-CYANOANTHRACENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₉N
CH$EXACT_MASS: 203.07350
CH$SMILES: N#Cc(c21)c(c3)c(ccc3)cc(cccc2)1
CH$IUPAC: InChI=1S/C15H9N/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H
CH$LINK: CAS 1210-12-4
CH$LINK: INCHIKEY KEQZHLAEKAVZLY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3049209

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0udi-3390000000-0d0fefbbfcd75a9fba27
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  39 2.17 22
  50 2.73 27
  51 2.32 23
  61 1.05 11
  62 2.58 26
  63 3.7 37
  74 4.54 45
  75 5.27 53
  76 1.83 18
  86 2.6 26
  87 5.29 53
  88 6.77 68
  98 2.88 29
  99 2.6 26
  100 1.55 16
  101 4.71 47
  102 1.27 13
  110 1.16 12
  111 1.81 18
  122 1.08 11
  123 1.37 14
  124 1.12 11
  126 1.72 17
  149 1.8 18
  150 4.91 49
  151 2.44 24
  152 1.58 16
  174 4.14 41
  175 6.76 68
  176 8.7 87
  177 5.21 52
  201 7.55 76
  202 7.16 72
  203 99.99 999
  204 17.01 170
  205 1.3 13
//