ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010308
RECORD_TITLE: META-AMINOBENZOIC ACID; 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$NAME: META-AMINOBENZOIC ACID
CH$NAME: 3-AMINOBENZOIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₇NO₂
CH$EXACT_MASS: 137.04768
CH$SMILES: Nc(c1)cc(cc1)C(O)=O
CH$IUPAC: InChI=1S/C7H7NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H,9,10)
CH$LINK: INCHIKEY XFDUHJPVQKIXHO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3059183

AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-000i-4900000000-e768f284b0ad9fa688a5
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  27 1.09 11
  28 2.77 28
  37 1.16 12
  38 3.07 31
  39 9.44 94
  40 1.1 11
  41 2.14 21
  45 4.61 46
  50 1.29 13
  51 1.12 11
  52 2.67 27
  53 1.54 15
  54 1.63 16
  62 1.5 15
  63 6.24 62
  64 2.48 25
  65 14.83 148
  66 2.96 30
  80 3.92 39
  81 1.12 11
  91 3.15 32
  92 13.28 133
  93 2.93 29
  94 2.7 27
  109 3.76 38
  120 39.24 392
  121 3.22 32
  137 99.99 999
  138 22.14 221
  139 1.81 18
//