ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000196
RECORD_TITLE: META HYDROXY ETHYLBENZOATE; 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$NAME: META HYDROXY ETHYLBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₃
CH$EXACT_MASS: 166.06299
CH$SMILES: CCOC(=O)c(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C9H10O3/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3
CH$LINK: INCHIKEY MWSMNBYIEBRXAL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10228435

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$SPLASH: splash10-00y3-9600000000-edbe94f6523669b7f131
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  26 1.52 15
  27 8.36 84
  28 1 10
  29 9.88 99
  37 1.22 12
  38 5.32 53
  39 31.46 315
  40 1.52 15
  43 1.22 12
  45 2.66 27
  50 4.33 43
  51 4.56 46
  53 5.4 54
  62 3.42 34
  63 12.46 125
  64 8.51 85
  65 43.54 435
  66 5.24 52
  74 1.82 18
  77 6.38 64
  81 2.28 23
  92 6.38 64
  93 52.58 526
  94 11.7 117
  105 4.48 45
  120 1.98 20
  121 99.99 999
  122 13.68 137
  138 25.84 258
  139 1.9 19
  151 3.27 33
  166 19.68 197
  167 2.13 21
//