ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011471
RECORD_TITLE: 4-PHENYLBENZYLALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: 4-PHENYLBENZYLALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₂O
CH$EXACT_MASS: 184.08882
CH$SMILES: OCc(c2)ccc(c2)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2
CH$LINK: INCHIKEY AXCHZLOJGKSWLV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5075234

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-001i-1900000000-37f29d9149b2b2bfc624
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  39 3.32 33
  50 1.8 18
  51 6.69 67
  52 1.52 15
  63 3.05 31
  65 1.19 12
  69 8.9 89
  74 1.01 10
  75 1.68 17
  76 3.01 30
  77 18.29 183
  78 8.62 86
  79 7.49 75
  89 2.12 21
  91 1.89 19
  92 1.63 16
  102 2.5 25
  105 3.58 36
  106 1.75 18
  107 8.29 83
  115 7.9 79
  116 1.11 11
  119 2.04 20
  126 2.37 24
  127 5.05 51
  128 6.5 65
  129 3.8 38
  131 2.51 25
  139 2.13 21
  141 2 20
  150 1.59 16
  151 5.29 53
  152 20.82 208
  153 15.97 160
  154 8.83 88
  155 56.85 569
  156 9.84 98
  164 1.36 14
  165 15.55 156
  166 11.91 119
  167 13.71 137
  168 2.36 24
  169 2.65 27
  181 5.57 56
  182 4.68 47
  183 21.47 215
  184 99.99 999
  185 15.82 158
  186 1.43 14
//