MassBank Record: JP001589

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ACENAPHTHENE; EI-B; MS

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ACCESSION: JP001589
RECORD_TITLE: ACENAPHTHENE; 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$NAME: ACENAPHTHENE
CH$NAME: 1,2-DIHYDROACENAPHTHYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10
CH$EXACT_MASS: 154.07825
CH$SMILES: c(c3)cc(C1)c(c32)c(ccc2)C1
CH$IUPAC: InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2
CH$LINK: CAS 83-32-9
CH$LINK: INCHIKEY CWRYPZZKDGJXCA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3021774

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$SPLASH: splash10-0udi-4900000000-c935620a466205270abe
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  50 8.27 83
  51 10.58 106
  52 1.69 17
  61 2.16 22
  62 7.18 72
  63 17.33 173
  64 7.18 72
  73 1.47 15
  74 8.18 82
  75 19.76 198
  76 46.22 462
  77 16.49 165
  78 1.31 13
  86 2.62 26
  87 3.41 34
  89 1.28 13
  98 2.8 28
  99 2 20
  100 1.15 12
  101 1.94 19
  102 2.11 21
  115 1.15 12
  125 2.08 21
  126 5.19 52
  127 3.26 33
  128 1.36 14
  149 2.72 27
  150 11.43 114
  151 27.26 273
  152 65.67 657
  153 92.28 923
  154 99.99 999
  155 10.33 103
//