MassBank Record: MSBNK-EPA-ENTACT_AGILENT000098
ACCESSION: MSBNK-EPA-ENTACT_AGILENT000098
RECORD_TITLE: N-Vinyl-2-pyrrolidone; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: N-Vinyl-2-pyrrolidone
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H9NO
CH$EXACT_MASS: 111.0684139168
CH$SMILES: C=CN1CCCC1=O
CH$IUPAC: InChI=1S/C6H9NO/c1-2-7-5-3-4-6(7)8/h2H,1,3-5H2
CH$LINK: CAS
88-12-0
CH$LINK: INCHIKEY
WHNWPMSKXPGLAX-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:6917
AC$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$MASS_SPECTROMETRY: COLLISION_ENERGY 10
MS$FOCUSED_ION: PRECURSOR_M/Z 112.0756903685
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-03xr-9700000000-a767044eab2e54d9283a
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
41.038577 16.281921 162
42.033826 1.454059 14
44.049476 5.665341 56
56.049476 2.003962 20
67.054227 1.024206 10
69.033491 75.209804 751
69.069877 5.461198 54
82.065126 2.091308 20
84.080776 17.72358 177
94.065126 1.33791 13
112.07569 100 999
//