MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012058
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012058
RECORD_TITLE: PYRROLIDINE-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SUMITA Y, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: PYRROLIDINE-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H7NO
CH$EXACT_MASS: 85.05276
CH$SMILES: O=C(C1)NCC1
CH$IUPAC: InChI=1S/C4H7NO/c6-4-2-1-3-5-4/h1-3H2,(H,5,6)
CH$LINK: INCHIKEY
HNJBEVLQSNELDL-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8027246
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001c-9000000000-7fd58ea01b9edb8fc097
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
27 4.19 42
28 21.55 216
29 7.85 79
30 41.7 417
39 2.86 29
40 6.64 66
41 34.2 342
42 46.47 465
43 1.68 17
44 1.04 10
55 1.53 15
56 8.82 88
57 1.26 13
84 22.43 224
85 99.99 999
86 8.79 88
87 0.46 5
//