ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011770
RECORD_TITLE: ORTHO-METHOXYACETOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ORTHO-METHOXYACETOPHENONE
CH$NAME: ORTHO-ACETYLANISOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.06808
CH$SMILES: COc(c1)c(ccc1)C(C)=O
CH$IUPAC: InChI=1S/C9H10O2/c1-7(10)8-5-3-4-6-9(8)11-2/h3-6H,1-2H3
CH$LINK: INCHIKEY DWPLEOPKBWNPQV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8060375

AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-000i-9700000000-676b8bbe30b58c5fa762
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 1.58 16
  29 2.49 25
  31 1.51 15
  37 1.05 11
  38 3.45 35
  39 5.06 51
  42 1.65 17
  43 18.31 183
  50 6.92 69
  51 9.88 99
  52 2.77 28
  53 2.45 25
  58 1 10
  61 1.18 12
  62 3.05 31
  63 10.94 109
  64 8.18 82
  65 5.43 54
  74 2.55 26
  75 2.14 21
  76 3.89 39
  77 37.07 371
  78 9.54 95
  79 4.35 44
  89 1.39 14
  91 3.35 34
  92 20.69 207
  93 2.49 25
  104 1.09 11
  105 3.45 35
  107 2.03 20
  120 4.85 49
  121 5.46 55
  133 1.48 15
  135 99.99 999
  136 8.85 89
  150 17.54 175
  151 1.16 12
//