ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000080
RECORD_TITLE: METHYL PARA AMINO BENZOATE; 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$NAME: METHYL PARA AMINO BENZOATE
CH$NAME: PARA AMINO BENZOIC ACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₉NO₂
CH$EXACT_MASS: 151.06333
CH$SMILES: COC(=O)c(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C8H9NO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,9H2,1H3
CH$LINK: INCHIKEY LZXXNPOYQCLXRS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7060704

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$SPLASH: splash10-00di-7900000000-b99d851d29a614f38099
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  27 1.67 17
  29 7.53 75
  31 13.05 131
  38 2.51 25
  39 9.87 99
  40 3.18 32
  41 5.02 50
  50 1.26 13
  51 1.26 13
  52 2.76 28
  62 1.76 18
  63 5.44 54
  64 4.77 48
  65 31.13 311
  66 3.35 34
  90 1.26 13
  91 3.35 34
  92 37.66 377
  93 4.02 40
  119 5.1 51
  120 99.99 999
  121 9.37 94
  122 1.76 18
  150 1.51 15
  151 38.08 381
  152 3.51 35
//