ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009631
RECORD_TITLE: ETHYL 4-AMINOBENZOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA

CH$NAME: ETHYL 4-AMINOBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₁NO₂
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOC(=O)c(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3
CH$LINK: INCHIKEY BLFLLBZGZJTVJG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021804

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-00di-5900000000-dcd2847110af7c87bf18
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  26 1.3 13
  27 4.8 48
  29 4.4 44
  39 0.62 6
  40 1.2 12
  41 1.9 19
  44 1.7 17
  52 0.16 2
  63 2.8 28
  64 3 30
  65 22.8 228
  66 0.36 4
  91 3.7 37
  92 24.2 242
  93 5.9 59
  108 0.21 2
  119 1.1 11
  120 99.99 999
  121 11.5 115
  137 1.61 16
  138 1.2 12
  150 1.3 13
  164 1.2 12
  165 4.7 47
  166 4.8 48
//