ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001321
RECORD_TITLE: PARA-AMINOBENZOIC ACID PROPYL 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$NAME: PARA-AMINOBENZOIC ACID PROPYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₃NO₂
CH$EXACT_MASS: 179.09463
CH$SMILES: CCCOC(=O)c(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C10H13NO2/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6H,2,7,11H2,1H3
CH$LINK: COMPTOX DTXSID3046299
CH$LINK: INCHIKEY NBFQYHKHPBMJJV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7174

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$SPLASH: splash10-00di-3900000000-3fde0cf3b4d99f06e7f0
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  27 2.23 22
  28 1.21 12
  39 5.48 55
  41 3.89 39
  43 1.15 12
  52 1.15 12
  63 1.85 19
  64 2.04 20
  65 18.47 185
  66 2.04 20
  78 1.91 19
  91 2.04 20
  92 21.08 211
  93 2.55 26
  108 3.82 38
  120 99.99 999
  121 9.43 94
  137 46.37 464
  138 3.38 34
  179 24.84 248
  180 2.42 24
//