MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010724

2'-HYDROXY-4',6'-DIMETHOXYACETOPHENONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010724
RECORD_TITLE: 2'-HYDROXY-4',6'-DIMETHOXYACETOPHENONE; 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

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CH$NAME: 2'-HYDROXY-4',6'-DIMETHOXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₄
CH$EXACT_MASS: 196.07356
CH$SMILES: COc(c1)cc(OC)c(C(C)=O)c(O)1
CH$IUPAC: InChI=1S/C10H12O4/c1-6(11)10-8(12)4-7(13-2)5-9(10)14-3/h4-5,12H,1-3H3
CH$LINK: INCHIKEY FBUBVLUPUDBFME-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10237981

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-001i-0900000000-3cd64b53df7c93b840ad
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  95 1.66 17
  110 1.25 13
  111 1.07 11
  123 1.63 16
  125 1.43 14
  138 3.73 37
  151 1.65 17
  166 5.65 57
  167 1.02 10
  178 7.13 71
  179 1.98 20
  181 99.99 999
  182 10.37 104
  183 1.19 12
  196 42.97 430
  197 4.95 50
//