ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005265
RECORD_TITLE: 2-AMINO-3-INDOLYLPROPIONIC ACID METHYL ESTER; EI-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
CH$NAME: 2-AMINO-3-INDOLYLPROPIONIC ACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H14N2O2
CH$EXACT_MASS: 218.10553
CH$SMILES: COC(=O)CCC1=C(NC2=CC=CC=C21)N
CH$IUPAC: InChI=1S/C12H14N2O2/c1-16-11(15)7-6-9-8-4-2-3-5-10(8)14-12(9)13/h2-5,14H,6-7,13H2,1H3
CH$LINK: INCHIKEY VTYXPORYQXCQHS-UHFFFAOYSA-N
AC$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: splash10-001i-0900000000-d084184b05dec2ac44cf
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  102 3.2 32
  103 6.1 61
  130 99.99 999
  131 0.86 9
  132 2.6 26
  159 4.6 46
  218 4.2 42
//
