ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008422
RECORD_TITLE: PARA-NONYLPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

CH$NAME: PARA-NONYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄O
CH$EXACT_MASS: 220.18272
CH$SMILES: CCCCCCCCCc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3
CH$LINK: INCHIKEY IGFHQQFPSIBGKE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5033836

AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-000i-2900000000-7a162fc7755b07f777e5
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  27 2.8 28
  29 7.52 75
  39 3.4 34
  41 15.24 152
  43 8.26 83
  55 8.82 88
  57 3.66 37
  65 2.25 23
  77 6.55 66
  91 5.49 55
  94 0.99 10
  95 4.47 45
  103 1.82 18
  105 1.32 13
  107 51.17 512
  108 3.09 31
  115 1.35 14
  119 2.84 28
  120 1.77 18
  121 49.27 493
  122 4.77 48
  133 1.78 18
  134 4.28 43
  135 99.99 999
  136 10.07 101
  147 0.58 6
  149 34.4 344
  150 3.54 35
  163 9.4 94
  164 0.48 5
  177 5.03 50
  191 5.53 55
  206 0.92 9
  220 7.25 73
  221 0.42 4
//