ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006382
RECORD_TITLE: PHENOXYETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PHENOXYETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₃
CH$EXACT_MASS: 180.07864
CH$SMILES: CC(=O)OCCOc(c1)cccc1
CH$IUPAC: InChI=1S/C10H12O3/c1-9(11)12-7-8-13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
CH$LINK: INCHIKEY WHFKYDMBUMLWDA-UHFFFAOYSA-N

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$SPLASH: splash10-000f-9000000000-aeb613bc8d646115d43d
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  15 7.07 71
  18 1.85 19
  27 2.72 27
  28 1.92 19
  29 1.58 16
  38 1.59 16
  39 10.22 102
  40 1.08 11
  42 2.17 22
  43 99.99 999
  44 2.15 22
  45 1.17 12
  50 2.49 25
  51 11.58 116
  63 2.08 21
  64 1.03 10
  65 9.2 92
  66 2.99 30
  77 20.6 206
  78 1.77 18
  79 2.29 23
  87 77.86 779
  88 2.75 28
  91 2.73 27
  94 15.22 152
  95 1.24 12
  107 2.52 25
  120 2.01 20
  180 2.38 24
//