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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009641

4-METHOXYPHENYL METHYL KETONE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009641
RECORD_TITLE: 4-METHOXYPHENYL METHYL KETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA

CH$NAME: 4-METHOXYPHENYL METHYL KETONE
CH$NAME: 4-METHOXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O2
CH$EXACT_MASS: 150.06808
CH$SMILES: COc(c1)ccc(c1)C(C)=O
CH$IUPAC: InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3
CH$LINK: INCHIKEY NTPLXRHDUXRPNE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2044347

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-002r-9700000000-e00e43b1125f4e22757a
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 2.2 22
  28 12.8 128
  29 3.2 32
  32 0.27 3
  38 5.6 56
  39 6 60
  42 3.2 32
  43 3.25 33
  50 9.8 98
  51 9.6 96
  52 3.2 32
  53 0.33 3
  61 1 10
  62 4.6 46
  63 21 210
  64 2.12 21
  65 4.8 48
  66 1.7 17
  74 3.3 33
  75 0.33 3
  76 6.7 67
  77 39 390
  78 7.7 77
  79 0.5 5
  89 1.4 14
  91 2.7 27
  92 31 310
  93 0.24 2
  104 1.5 15
  107 16.2 162
  108 1.3 13
  119 0.1 1
  120 1.5 15
  121 2.1 21
  135 99.99 999
  136 0.89 9
  150 34.8 348
  151 3.7 37
//

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