ACCESSION: MSBNK-EPA-ENTACT_AGILENT000100
RECORD_TITLE: 1-(2-Hydroxyethyl)pyrrolidin-2-one; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 1-(2-Hydroxyethyl)pyrrolidin-2-one
CH$NAME: DTXSID7044922
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₁NO₂
CH$EXACT_MASS: 129.0789786029
CH$SMILES: OCCN1CCCC1=O
CH$IUPAC: InChI=1S/C6H11NO2/c8-5-4-7-3-1-2-6(7)9/h8H,1-5H2
CH$LINK: CAS 3445-11-2
CH$LINK: INCHIKEY WDQFELCEOPFLCZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:76980

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$FOCUSED_ION: PRECURSOR_M/Z 130.0862550546
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-9000000000-53e4df94e045e9b36074
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  39.022927 29.353359 293
  41.038577 99.999995 999
  41.059706 2.407029 24
  42.033826 4.550886 45
  43.054227 1.157334 11
  44.01309 1.735218 17
  44.049476 6.9951 69
  45.033491 7.576557 75
  54.033826 1.13603 11
  56.049476 6.497067 64
  67.041651 1.657728 16
  67.054227 1.468904 14
  68.049476 1.218028 12
  69.033491 14.048451 140
//