ACCESSION: MSBNK-EPA-ENTACT_AGILENT001254
RECORD_TITLE: DL-Glutamic acid; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: DL-Glutamic acid
CH$NAME: DTXSID6047155
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₉NO₄
CH$EXACT_MASS: 147.0531577837
CH$SMILES: NC(CCC(O)=O)C(O)=O
CH$IUPAC: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)
CH$LINK: CAS 617-65-2
CH$LINK: INCHIKEY WHUUTDBJXJRKMK-UHFFFAOYSA-N

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 146.045881332
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0udi-2900000000-d28b25e10580d0754e1f
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  41.003288 1.336231 13
  41.998537 1.540227 15
  44.998203 2.547377 25
  54.034923 1.338113 13
  56.014187 3.016754 30
  57.034588 3.204434 32
  59.013853 2.356483 23
  68.998203 1.418513 14
  71.013853 6.310704 63
  74.024752 7.573463 75
  82.029837 2.358084 23
  102.056052 99.999999 999
  128.035317 17.142604 171
  146.045881 6.035568 60
//