MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005659

3-PHENYLPROPYL ALCOHOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005659
RECORD_TITLE: 3-PHENYLPROPYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

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CH$NAME: 3-PHENYLPROPYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₂O
CH$EXACT_MASS: 136.08882
CH$SMILES: OCCCc(c1)cccc1
CH$IUPAC: InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
CH$LINK: INCHIKEY VAJVDSVGBWFCLW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6041638

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AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-014l-5900000000-c47a97802ac7bbbfd8a8
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  31 2.38 24
  58 1.01 10
  65 5.82 58
  77 5.46 55
  78 10.41 104
  79 16.27 163
  90 2.77 28
  91 89.98 900
  92 72.13 721
  93 7.63 76
  103 16.08 161
  104 2.63 26
  105 21.42 214
  115 5.72 57
  116 11.15 112
  117 99.99 999
  118 98.18 982
  119 17.38 174
  136 49.8 498
  137 4.82 48
//