ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009487
RECORD_TITLE: 1,3-DIETHYLBENZENE; 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$NAME: 1,3-DIETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: CCc(c1)cc(CC)cc1
CH$IUPAC: InChI=1S/C10H14/c1-3-9-6-5-7-10(4-2)8-9/h5-8H,3-4H2,1-2H3
CH$LINK: CAS 141-93-5
CH$LINK: INCHIKEY AFZZYIJIWUTJFO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1022003

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$SPLASH: splash10-067i-3900000000-09b6243b09a923315a46
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  15 3.39 34
  26 1.2 12
  27 7.04 70
  28 2.01 20
  29 4.73 47
  31 6.49 65
  39 6.83 68
  41 4.8 48
  45 3.09 31
  46 1.34 13
  50 1.77 18
  51 5.82 58
  52 1.74 17
  53 1.97 20
  57 1.03 10
  63 3.97 40
  64 1.15 12
  65 6.32 63
  77 13.78 138
  78 6.04 60
  79 9.05 91
  89 3 30
  91 28.36 284
  92 2.65 27
  93 2.73 27
  102 2.44 24
  103 10.85 109
  104 7.74 77
  105 99.99 999
  106 9.76 98
  107 1.13 11
  115 10.24 102
  116 3.09 31
  117 15.55 156
  118 3.28 33
  119 87.39 874
  120 8.92 89
  128 1.14 11
  133 2.05 21
  134 58.83 588
  135 7.34 73
//