ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004039
RECORD_TITLE: PARA-ISOPROPYLPHENOL; 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

CH$NAME: PARA-ISOPROPYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₂O
CH$EXACT_MASS: 136.08882
CH$SMILES: CC(C)c(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3
CH$LINK: INCHIKEY YQUQWHNMBPIWGK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5042299

AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-00di-3900000000-8ad6a5d0a64e2c14751b
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 2.2 22
  28 5 50
  39 4.3 43
  41 0.26 3
  50 1.2 12
  51 2 20
  53 1.9 19
  55 0.17 2
  59 1.5 15
  60 1.6 16
  60.5 1.1 11
  63 0.12 1
  65 4.3 43
  66 1.9 19
  77 12 120
  78 0.18 2
  79 1.6 16
  91 10 100
  92 1.2 12
  93 0.3 3
  94 1.6 16
  95 1.3 13
  103 12.5 125
  104 0.14 1
  107 2.7 27
  119 1.3 13
  120 2 20
  121 99.99 999
  122 9 90
  135 1.5 15
  136 28.9 289
  137 3.4 34
//