ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008611
RECORD_TITLE: BENZYLACETOPHENONE; 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$NAME: BENZYLACETOPHENONE
CH$NAME: 3-PHENYLPROPIOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₄O
CH$EXACT_MASS: 210.10447
CH$SMILES: O=C(CCc(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H14O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
CH$LINK: INCHIKEY QGGZBXOADPVUPN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7061481

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$SPLASH: splash10-0a4i-7930000000-932c5f7279d2b7703686
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  18 1.71 17
  27 2.4 24
  39 2.95 30
  50 2.93 29
  51 10.54 105
  52 1.47 15
  63 1.61 16
  65 3.42 34
  76 1.57 16
  77 43.43 434
  78 4.69 47
  79 2.53 25
  89 1.03 10
  91 9.02 90
  103 2.96 30
  104 4.27 43
  105 99.99 999
  106 6.79 68
  209 1.71 17
  210 32.89 329
  211 4.9 49
//