ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007151
RECORD_TITLE: BENZOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: BENZOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₀O
CH$EXACT_MASS: 182.07316
CH$SMILES: c(c2)ccc(c2)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
CH$LINK: CAS 119-61-9
CH$LINK: INCHIKEY RWCCWEUUXYIKHB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0021961

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0a6r-7900000000-95f4bdf3395ce8c0bc20
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  27 1.96 20
  39 1.98 20
  50 10.38 104
  51 31.56 316
  52 1.71 17
  63 1.05 11
  74 2.87 29
  75 2.1 21
  76 4.21 42
  77 69.37 694
  78 3.81 38
  105 99.99 999
  106 5.89 59
  152 2.4 24
  153 1.38 14
  154 1.56 16
  181 4.43 44
  182 41.07 411
  183 4.47 45
//