ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002139
RECORD_TITLE: PHENYL ACETIC ACID ETHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: PHENYL ACETIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₂
CH$EXACT_MASS: 164.08373
CH$SMILES: CCOC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C10H12O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
CH$LINK: INCHIKEY DULCUDSUACXJJC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6044353

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0006-9100000000-582a1e3bd3dd7bf289d2
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  15 1.2 12
  27 2.58 26
  28 2.45 25
  29 18.32 183
  39 4.69 47
  41 1.49 15
  44 7.44 74
  45.5 1.32 13
  50 1.32 13
  51 3.38 34
  59 1.26 13
  63 2.75 28
  65 10.13 101
  77 3.55 36
  78 1.03 10
  89 2.86 29
  90 2.18 22
  91 99.99 999
  92 10.53 105
  105 6.41 64
  106 2.12 21
  118 1.09 11
  119 2.29 23
  149 5.67 57
  164 14.77 148
  165 1.72 17
//