MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009217

P-PROPYLPHENOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009217
RECORD_TITLE: P-PROPYLPHENOL; 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$NAME: P-PROPYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₂O
CH$EXACT_MASS: 136.08882
CH$SMILES: CCCc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C9H12O/c1-2-3-8-4-6-9(10)7-5-8/h4-7,10H,2-3H2,1H3
CH$LINK: INCHIKEY KLSLBUSXWBJMEC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9022100

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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$SPLASH: splash10-0a4i-3900000000-858c711ebaae485560d5
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  27 5.35 54
  29 1.91 19
  39 6.42 64
  41 1.55 16
  50 1.4 14
  51 4.63 46
  52 1.98 20
  53 3.33 33
  55 1.62 16
  63 2.07 21
  65 2.65 27
  77 12.95 130
  78 4.21 42
  79 1.85 19
  91 1.94 19
  94 1.06 11
  107 99.99 999
  108 7.75 78
  136 19.36 194
  137 1.63 16
//