ACCESSION: MSBNK-EPA-ENTACT_AGILENT000101
RECORD_TITLE: 1-(2-Hydroxyethyl)pyrrolidin-2-one; ESI-QTOF; MS2; CE: 20; [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 20

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$SPLASH: splash10-02tc-9300000000-d64de8d2b475d22ee479
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  39.022927 1.331202 13
  41.038577 42.407408 423
  41.059706 1.084418 10
  42.033826 3.5189 35
  43.054227 1.45295 14
  44.049476 13.171141 131
  45.033491 1.082527 10
  56.049476 5.14925 51
  67.054227 2.766052 27
  69.033491 100 999
  69.069877 6.241959 62
  82.065126 5.214627 52
  84.080776 33.133871 331
  94.065126 2.183406 21
  112.07569 73.027673 729
  130.086255 5.889664 58
//