ACCESSION: MSBNK-EPA-ENTACT_AGILENT001470
RECORD_TITLE: N-Phenylglycine; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-Phenylglycine
CH$NAME: DTXSID0027806
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₉NO₂
CH$EXACT_MASS: 151.0633285391
CH$SMILES: OC(=O)CNC1C=CC=CC=1
CH$IUPAC: InChI=1S/C8H9NO2/c10-8(11)6-9-7-4-2-1-3-5-7/h1-5,9H,6H2,(H,10,11)
CH$LINK: CAS 103-01-5
CH$LINK: INCHIKEY NPKSPKHJBVJUKB-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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 152.0706049908
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-9000000000-57d085d46be1a60665a7
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  51.022927 25.172642 251
  63.994366 3.211121 32
  65.038577 3.886508 38
  66.046402 14.251503 142
  77.038577 100.000003 999
  78.046402 6.81541 68
  79.054227 15.279138 152
  92.049476 5.929802 59
  93.057301 32.521355 324
  106.065126 19.955216 199
//