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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010714

2',5'-DIHYDROXYACETOPHENONE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010714
RECORD_TITLE: 2',5'-DIHYDROXYACETOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SUMITA Y, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 2',5'-DIHYDROXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H8O3
CH$EXACT_MASS: 152.04734
CH$SMILES: CC(=O)c(c1)c(O)ccc(O)1
CH$IUPAC: InChI=1S/C8H8O3/c1-5(9)7-4-6(10)2-3-8(7)11/h2-4,10-11H,1H3
CH$LINK: INCHIKEY WLDWSGZHNBANIO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9060077

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 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0f79-1900000000-8e9a7c4012d3cd5b5c54
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  27 1.05 11
  43 7.1 71
  53 4.03 40
  55 1.11 11
  69 3.59 36
  77 1.44 14
  78 1.77 18
  81 13.23 132
  82 1.14 11
  105 1.19 12
  108 1.26 13
  109 13.85 139
  110 2.08 21
  134 4.32 43
  137 99.99 999
  138 7.79 78
  152 85.31 853
  153 7.62 76
  154 0.91 9
//

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