ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003785
RECORD_TITLE: ETHYL 4-ACETYLAMINOBENZOATE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: ETHYL 4-ACETYLAMINOBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₃NO₃
CH$EXACT_MASS: 207.08954
CH$SMILES: CCOC(=O)c(c1)ccc(NC(C)=O)c1
CH$IUPAC: InChI=1S/C11H13NO3/c1-3-15-11(14)9-4-6-10(7-5-9)12-8(2)13/h4-7H,3H2,1-2H3,(H,12,13)
CH$LINK: INCHIKEY NHLOBHNRBWKNIO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60277615

AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0a4i-0090000000-eaa2adfbfffd7182d456
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  63 0.31 3
  65 0.49 5
  67 0.11 1
  79 0.21 2
  91 0.16 2
  92 0.25 3
  93 0.15 2
  120 1.85 19
  121 0.22 2
  137 0.6 6
  162 1.71 17
  165 2.18 22
  166 0.49 5
  176 0.32 3
  180 0.25 3
  194 0.57 6
  206 0.81 8
  207 8.98 90
  208 99.99 999
  209 13.5 135
  210 1.56 16
//