ACCESSION: MSBNK-Keio_Univ-KO001804
RECORD_TITLE: Succinimide; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID S015

CH$NAME: Succinimide
CH$NAME: Butanimide
CH$NAME: 2,5-Pyrrolidinedione
CH$NAME: 2,5-Diketopyrrolidine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₅NO₂
CH$EXACT_MASS: 99.03203
CH$SMILES: O=C(C1)NC(=O)C1
CH$IUPAC: InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
CH$LINK: CAS 123-56-8
CH$LINK: CHEBI 9307
CH$LINK: KEGG C07273
CH$LINK: NIKKAJI J25.395B
CH$LINK: PUBCHEM SID:9482
CH$LINK: INCHIKEY KZNICNPSHKQLFF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8051629

AC$INSTRUMENT: API3000, Applied Biosystems
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V

MS$FOCUSED_ION: PRECURSOR_M/Z 98
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-

PK$SPLASH: splash10-0005-9000000000-9154f606bafc62e4d44f
PK$NUM_PEAK: 2
PK$PEAK: m/z int. rel.int.
42.000 633664.0 836
98.300 757426.5 999
//