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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000079

ANTHRANILIC ACID METHYL ESTER; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000079
RECORD_TITLE: ANTHRANILIC ACID METHYL 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$NAME: ANTHRANILIC ACID METHYL ESTER
CH$NAME: METHYL ORTHO AMINO BENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H9NO2
CH$EXACT_MASS: 151.06333
CH$SMILES: COC(=O)c(c1)c(N)ccc1
CH$IUPAC: InChI=1S/C8H9NO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,9H2,1H3
CH$LINK: INCHIKEY VAMXMNNIEUEQDV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6025567

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$SPLASH: splash10-014l-9700000000-dfe3727f600ad4c1a3fc
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 1.41 14
  29 2.25 23
  37 1.48 15
  38 4.78 48
  39 16.53 165
  40 3.52 35
  41 5.27 53
  50 2.04 20
  51 2.11 21
  52 6.68 67
  62 2.67 27
  63 9.99 100
  64 13.36 134
  65 39.94 399
  66 4.99 50
  90 3.09 31
  91 10.62 106
  92 75.25 753
  93 6.4 64
  119 99.99 999
  120 29.4 294
  121 2.25 23
  151 41.21 412
  152 3.66 37
//

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