MassBank Record: KO000845



 L-Glutamine; 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: KO000845
RECORD_TITLE: L-Glutamine; 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 G018

CH$NAME: L-Gln CH$NAME: L-2-Aminoglutaramic acid CH$NAME: L-Glutamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H10N2O3 CH$EXACT_MASS: 146.06914 CH$SMILES: NC(=O)CC[C@H](N)C(O)=O CH$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-/m0/s1 CH$LINK: CAS 56-85-9 CH$LINK: CHEBI 18050 CH$LINK: CHEMPDB GLN CH$LINK: KEGG C00064 CH$LINK: NIKKAJI J9.170G CH$LINK: PUBCHEM SID:3364
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 145 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-059x-9200000000-87603100e9cb637b9f35 PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 42.000 1321783.5 999 55.700 29703.0 22 57.100 64356.5 49 58.000 628713.5 475 67.000 262376.5 198 69.700 44554.5 34 71.300 158416.0 120 72.800 24752.5 19 74.000 762377.0 576 81.000 29703.0 22 82.100 341584.5 258 83.500 34653.5 26 84.000 955446.5 722 85.800 103960.5 79 97.200 39604.0 30 99.000 99010.0 75 100.700 123762.5 94 108.200 29703.0 22 109.000 361386.5 273 127.100 569307.5 430 128.100 99010.0 75 145.600 19802.0 15 //