ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010542
RECORD_TITLE: BIBENZYL; 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$NAME: BIBENZYL
CH$NAME: 1,2-DIPHENYLETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₄
CH$EXACT_MASS: 182.10955
CH$SMILES: c(c2)ccc(c2)CCc(c1)cccc1
CH$IUPAC: InChI=1S/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2
CH$LINK: CAS 103-29-7
CH$LINK: INCHIKEY QWUWMCYKGHVNAV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8041668

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$SPLASH: splash10-0006-9200000000-5d440d73172c74b69ca1
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  27 4.07 41
  28 5 50
  32 1.82 18
  38 1.37 14
  39 19.59 196
  40 1.66 17
  41 5.95 60
  50 5.2 52
  51 14.67 147
  52 3.64 36
  53 1.22 12
  62 2.36 24
  63 9.36 94
  64 1.81 18
  65 40.95 410
  66 2.4 24
  74 1.66 17
  75 2.42 24
  76 2.61 26
  77 9.99 100
  78 3.92 39
  79 1.08 11
  89 5.55 56
  90 2.06 21
  91 99.99 999
  92 19.67 197
  102 1.92 19
  103 4.16 42
  104 6.66 67
  115 1.91 19
  152 1.72 17
  165 3.28 33
  166 1.24 12
  178 2.37 24
  179 1.79 18
  182 46.48 465
  183 7.56 76
//