ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008578
RECORD_TITLE: 1-PHENYL-3-BUTANOL; 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

CH$NAME: 1-PHENYL-3-BUTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄O
CH$EXACT_MASS: 150.10447
CH$SMILES: CC(O)CCc(c1)cccc1
CH$IUPAC: InChI=1S/C10H14O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3
CH$LINK: INCHIKEY GDWRKZLROIFUML-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60862904

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

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00kf-9600000000-1f41f661aea293fbf718
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  15 1.35 14
  19 1.13 11
  27 6.79 68
  29 2.92 29
  31 2.39 24
  39 9.28 93
  41 2.54 25
  43 9.51 95
  44 1.79 18
  45 34.72 347
  50 2.88 29
  51 10.92 109
  52 2.8 28
  53 1.55 16
  54 1.79 18
  57 1.31 13
  59 1.47 15
  62 1.2 12
  63 4.04 40
  64 1.37 14
  65 15.06 151
  66 1.03 10
  74 1.01 10
  75 1.01 10
  76 1.2 12
  77 15.6 156
  78 27.94 279
  79 10.04 100
  89 2.89 29
  90 1.18 12
  91 95.72 957
  92 47.17 472
  93 2.91 29
  102 1.23 12
  103 7.73 77
  104 7.58 76
  105 13.3 133
  106 2.48 25
  115 5.63 56
  116 1.48 15
  117 99.99 999
  118 10.01 100
  131 9.81 98
  132 60.19 602
  133 7 70
  150 11.01 110
  151 1.08 11
//