ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011472
RECORD_TITLE: 4-PHENOXYBENZYLALCOHOL; 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$NAME: 4-PHENOXYBENZYLALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₂O₂
CH$EXACT_MASS: 200.08373
CH$SMILES: OCc(c2)ccc(c2)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C13H12O2/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9,14H,10H2
CH$LINK: INCHIKEY FEOMFFKZOZMBKD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40356553

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$SPLASH: splash10-0ufr-9530000000-455d18a21cfdecb43c2c
PK$NUM_PEAK: 65
PK$PEAK: m/z int. rel.int.
  38 1.7 17
  39 16.12 161
  40 2.34 23
  41 6.59 66
  50 7.56 76
  51 33.83 338
  52 4.99 50
  53 2.94 29
  55 2.63 26
  62 1.42 14
  63 7.49 75
  64 3.32 33
  65 27.43 274
  66 8.25 83
  67 5.78 58
  74 1.48 15
  75 2.01 20
  76 3.62 36
  77 62.82 628
  78 12.06 121
  79 32.99 330
  80 2.01 20
  89 6.07 61
  90 1.66 17
  91 3.12 31
  92 1.13 11
  93 13.43 134
  94 3.17 32
  95 5.65 57
  100 1.15 12
  105 2.63 26
  106 0.92 9
  107 29.86 299
  108 2.31 23
  115 11.23 112
  116 1.37 14
  121 1.09 11
  122 2.53 25
  123 2.34 23
  127 1.99 20
  128 3.61 36
  129 1.69 17
  139 3.34 33
  141 6.85 69
  142 1.88 19
  151 0.88 9
  152 4.2 42
  153 9.04 90
  154 2.04 20
  155 3.8 38
  168 1.23 12
  169 3.63 36
  170 1.31 13
  171 16.24 162
  172 2.35 24
  181 7.08 71
  182 1.19 12
  183 14.49 145
  184 3.7 37
  197 3.23 32
  198 2.85 29
  199 20.74 207
  200 99.99 999
  201 14.33 143
  202 1.09 11
//