ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001002
RECORD_TITLE: META-AMINOBENZOIC ACID ETHYL ESTER; 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$NAME: META-AMINOBENZOIC ACID ETHYL ESTER
CH$NAME: ETHYL META-AMINOBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₁NO₂
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOC(=O)c(c1)cc(N)cc1
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2,10H2,1H3
CH$LINK: INCHIKEY ZMCBYSBVJIMENC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1044011

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$SPLASH: splash10-01bc-8900000000-bf2dac372aedc49840de
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 6.13 61
  28 4.53 45
  29 6.33 63
  38 2.72 27
  39 14.85 149
  40 1.43 14
  41 4.5 45
  42 1.36 14
  43 1.36 14
  46 3.27 33
  50 1.23 12
  51 1.23 12
  52 3.41 34
  60 4.09 41
  62 1.5 15
  63 6.06 61
  64 6.13 61
  65 42.44 424
  66 7.08 71
  91 7.36 74
  92 78.54 785
  93 36.99 370
  94 2.59 26
  109 1.7 17
  119 1.98 20
  120 99.99 999
  121 16.42 164
  137 30.99 310
  138 2.25 23
  150 4.29 43
  165 80.52 805
  166 8.04 80
//