MassBank Record: KO000297



 Azetidine-2-carboxylic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000297
RECORD_TITLE: Azetidine-2-carboxylic acid; LC-ESI-QQ; MS2; CE:10 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 A219

CH$NAME: Azetidine-2-carboxylate CH$NAME: L-Azetidine 2-carboxylic acid CH$NAME: Azetidyl-2-carboxylic acid CH$NAME: (S)-(-)-Azetidine-2-carboxylic acid CH$NAME: Azetidine-2-carboxylic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C4H7NO2 CH$EXACT_MASS: 101.04768 CH$SMILES: OC(=O)[C@H](C1)NC1 CH$IUPAC: InChI=1S/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1 CH$LINK: CAS 2133-34-8 CH$LINK: KEGG C08267 CH$LINK: NIKKAJI J35.234I CH$LINK: PUBCHEM SID:10466
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 100 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0002-9000000000-9456dd9fe8a1b16c8e0a PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 71.100 49505.0 11 71.800 94059.5 22 99.900 4311885.5 999 //