MassBank Record: KO001058



 cis-4-Hydroxyproline; LC-ESI-QQ; MS2; CE:20 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001058
RECORD_TITLE: cis-4-Hydroxyproline; LC-ESI-QQ; MS2; CE:20 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 H048

CH$NAME: cis-4-Hydroxyproline CH$NAME: cis-4-Hydroxy-D-proline CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H9NO3 CH$EXACT_MASS: 131.05824 CH$SMILES: O[C@@H](C1)C[C@@H](N1)C(O)=O CH$IUPAC: InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4-/m1/s1 CH$LINK: CAS 2584-71-6 CH$LINK: CHEBI 16231 CH$LINK: KEGG C03440 CH$LINK: NIKKAJI J192.095B CH$LINK: PUBCHEM SID:6264
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 130 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-004i-1900000000-02d8e1c3f73ac18ecfde PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 57.300 44554.5 2 58.200 59406.0 2 65.800 183168.5 7 68.000 415842.0 17 71.000 306931.0 12 72.900 376238.0 15 82.500 262376.5 11 84.200 2168319.0 88 86.100 69307.0 3 99.000 54455.5 2 110.100 19802.0 1 112.200 1787130.5 72 128.000 292079.5 12 128.800 19802.0 1 129.900 24742599.0 999 //