MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004944

PHENYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004944
RECORD_TITLE: PHENYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

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CH$NAME: PHENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₂
CH$EXACT_MASS: 136.05243
CH$SMILES: CC(=O)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3
CH$LINK: CAS 122-79-2
CH$LINK: INCHIKEY IPBVNPXQWQGGJP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3051626

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AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-0006-9000000000-aa83092457f08d648525
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  42 2.03 20
  43 26.01 260
  44 1.7 17
  50 1.75 18
  51 2.37 24
  55 1.44 14
  63 2.27 23
  65 6.07 61
  66 7.84 78
  77 2.1 21
  93 1.34 13
  94 99.99 999
  95 6.67 67
  136 10.87 109
//