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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005645

METHYL ANTHRANILATE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005645
RECORD_TITLE: METHYL ANTHRANILATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: METHYL ANTHRANILATE
CH$NAME: 2-AMINOBENZOIC ACID METHYL ESTER
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$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0gb9-4900000000-aadfdb770e0e737f8b6a
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  39 2.26 23
  64 3.62 36
  65 19.2 192
  66 2.48 25
  90 2.14 21
  91 8.65 87
  92 57.08 571
  93 5.64 56
  94 4.02 40
  119 99.99 999
  120 33.16 332
  121 1.92 19
  151 61.71 617
  152 5.06 51
//

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