MassBank Record: KO002924



 D-Glutamine; 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: KO002924
RECORD_TITLE: D-Glutamine; 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 G006

CH$NAME: D-Gln CH$NAME: D-2-Aminoglutaramic acid CH$NAME: D-Glutamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H10N2O3 CH$EXACT_MASS: 146.06914 CH$SMILES: NC(=O)CCC(N)C(O)=O CH$IUPAC: InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m1/s1 CH$LINK: CAS 5959-95-5 CH$LINK: CHEBI 17061 CH$LINK: CHEMPDB DGN CH$LINK: KEGG C00819 CH$LINK: NIKKAJI J9.211H CH$LINK: PUBCHEM SID:4077
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 147 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-001i-0900000000-51bf3e28fa7698abc6f9 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 49.800 54455.5 1 54.900 44554.5 1 63.900 14851.5 1 68.700 24752.5 1 73.700 44554.5 1 78.200 49505.0 1 83.000 2198022.0 14 84.200 2782181.0 18 85.400 9901.0 1 88.800 14851.5 1 92.800 29703.0 1 97.800 29703.0 1 100.700 29703.0 1 101.700 74257.5 1 102.200 49505.0 1 111.900 34653.5 1 112.300 44554.5 1 115.400 123762.5 1 128.800 128713.0 1 130.100 152549657.5 999 147.300 2673270.0 18 148.200 366337.0 2 152.800 14851.5 1 //