MassBank Record: KO000100



 1-Amino-1-cyclopentanecarboxylic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000100
RECORD_TITLE: 1-Amino-1-cyclopentanecarboxylic acid; 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 A050

CH$NAME: 1-Amino-1-cyclopentanecarboxylate CH$NAME: 1-Aminocyclopentanecarboxylic acid CH$NAME: 1-Aminocyclopentanecarboxylate CH$NAME: 1-Amino-1-cyclopentanecarboxylic acid CH$COMPOUND_CLASS: Non-Natural Product CH$FORMULA: C6H11NO2 CH$EXACT_MASS: 129.07898 CH$SMILES: OC(=O)C(N)(C1)CCC1 CH$IUPAC: InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9) CH$LINK: CAS 52-52-8 CH$LINK: KEGG C03969 CH$LINK: NIKKAJI J4.131I CH$LINK: PUBCHEM SID:6689
AC$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$FOCUSED_ION: PRECURSOR_M/Z 128 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-004i-1900000000-e3776623b288605d7c79 PK$NUM_PEAK: 4 PK$PEAK: m/z int. rel.int. 45.600 29703.0 26 45.900 163366.5 143 82.400 34653.5 30 128.200 1143565.5 999 //