ACCESSION: MSBNK-EPA-ENTACT_AGILENT001253
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 POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 148.0604342354
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-9000000000-4c8458c3bfc54aae631b
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  41.038577 12.169772 121
  56.049476 18.347528 183
  84.04439 99.999999 999
  84.080776 1.779813 17
  85.028406 2.108065 21
  102.054955 6.103836 60
//