ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002067
RECORD_TITLE: 2-(4-METHOXYPHENYL)ETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ENDO K, PHARMACEUTICAL INST., TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 2-(4-METHOXYPHENYL)ETHYL ACETATE
CH$NAME: PARA-METHOXYPHENETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H14O3
CH$EXACT_MASS: 194.09429
CH$SMILES: COc(c1)ccc(CCOC(C)=O)c1
CH$IUPAC: InChI=1S/C11H14O3/c1-9(12)14-8-7-10-3-5-11(13-2)6-4-10/h3-6H,7-8H2,1-2H3
CH$LINK: INCHIKEY OBGXWJYYWCNXIT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID80177047
AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-1900000000-ce6ded10c0e107746d69
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  18 2.4 24
  28 2.4 24
  43 10.4 104
  51 0.08 1
  55 0.8 8
  58 0.8 8
  65 1.6 16
  67 0.08 1
  71 0.8 8
  77 4.8 48
  78 3.2 32
  79 0.16 2
  90 0.8 8
  91 7.2 72
  92 1.6 16
  102 0.08 1
  103 1.6 16
  104 0.8 8
  105 1.6 16
  106 0.08 1
  107 0.8 8
  108 0.8 8
  119 12 120
  120 0.16 2
  121 40.8 408
  122 4.8 48
  123 0.8 8
  134 99.99 999
  135 12 120
  136 1.6 16
  194 1.6 16
  195 0.8 8
//
