MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003784

ETHYL 4-AMINOBENZOATE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003784
RECORD_TITLE: ETHYL 4-AMINOBENZOATE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

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CH$NAME: ETHYL 4-AMINOBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₁NO₂
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOC(=O)c(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3
CH$LINK: INCHIKEY BLFLLBZGZJTVJG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021804

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AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

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PK$SPLASH: splash10-014i-0900000000-49302e8e4fd5158a36da
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  63 0.16 2
  65 0.74 7
  67 0.1 1
  81 0.13 1
  92 0.47 5
  93 0.25 3
  94 0.14 1
  120 4.28 43
  121 0.71 7
  122 0.41 4
  134 0.41 4
  137 0.32 3
  138 0.63 6
  162 0.12 1
  165 10.52 105
  166 99.99 999
  167 9.9 99
  168 0.84 8
//