MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009212

PHENOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009212
RECORD_TITLE: PHENOL; 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$NAME: PHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₆O
CH$EXACT_MASS: 94.04186
CH$SMILES: Oc(c1)cccc1
CH$IUPAC: InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
CH$LINK: INCHIKEY ISWSIDIOOBJBQZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021124

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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$SPLASH: splash10-0006-9000000000-db80d8b605e20595c679
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  26 1.38 14
  27 2.26 23
  29 1.58 16
  37 2.55 26
  38 4.85 49
  39 17.95 180
  40 7.84 78
  47 2.55 26
  50 3.94 39
  51 3.89 39
  53 2.37 24
  55 6.01 60
  61 1.69 17
  62 2.6 26
  63 4.72 47
  64 1.95 20
  65 19.92 199
  66 27.46 275
  67 1.55 16
  68 1.06 11
  74 1.48 15
  93 1.69 17
  94 99.99 999
  95 5.76 58
//