MassBank Record: KO001635



 DL-Pipecolic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001635
RECORD_TITLE: DL-Pipecolic acid; LC-ESI-QQ; MS2; CE:50 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 P048

CH$NAME: Pipecolate CH$NAME: Pipecolic acid CH$NAME: L-Pipecolate CH$NAME: 2-Piperidinecarboxylic acid CH$NAME: Pipecolinic acid CH$NAME: DL-Pipecolic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H11NO2 CH$EXACT_MASS: 129.07898 CH$SMILES: OC(=O)C([H])(C1)NCCC1 CH$IUPAC: InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1 CH$LINK: CAS 3105-95-1 CH$LINK: CHEBI 30913 CH$LINK: KEGG C00408 CH$LINK: NIKKAJI J215.717I CH$LINK: PUBCHEM SID:3698
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 128 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0002-9000000000-5a62167bd787768808f7 PK$NUM_PEAK: 1 PK$PEAK: m/z int. rel.int. 46.100 39604.0 999 //