MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008497

METHYL PHENYLACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008497
RECORD_TITLE: METHYL PHENYLACETATE; 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

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CH$NAME: METHYL PHENYLACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.06808
CH$SMILES: COC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
CH$LINK: INCHIKEY CRZQGDNQQAALAY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1044352

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0006-9100000000-1edd67a79f223f827641
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  15 4.17 42
  29 1.79 18
  38 1.3 13
  39 8.06 81
  41 1.29 13
  50 2.06 21
  51 3.99 40
  52 1.16 12
  59 6.69 67
  62 1.73 17
  63 6.23 62
  64 1.57 16
  65 14.83 148
  77 1.12 11
  89 4.81 48
  90 3.18 32
  91 99.99 999
  92 7.52 75
  105 1.09 11
  119 1.44 14
  150 24 240
  151 2.32 23
//