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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010023

2-PHENOXYETHANOL; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010023
RECORD_TITLE: 2-PHENOXYETHANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 2-PHENOXYETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O2
CH$EXACT_MASS: 138.06808
CH$SMILES: OCCOc(c1)cccc1
CH$IUPAC: InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2
CH$LINK: INCHIKEY QCDWFXQBSFUVSP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021976

AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-0006-9000000000-480278f55ce8ffc42edb
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  27 2.5 25
  39 5.9 59
  45 8.1 81
  50 0.17 2
  51 8.1 81
  55 2 20
  65 5.5 55
  66 0.88 9
  77 25.3 253
  78 2.5 25
  79 4.4 44
  87 0.2 2
  94 99.99 999
  95 16.4 164
  107 7.5 75
  138 3.55 36
  139 2.7 27
//

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