MassBank Record: KO003024



 Gly-Leu; 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: KO003024
RECORD_TITLE: Gly-Leu; 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 G071

CH$NAME: Gly-Leu CH$NAME: Glycyl-L-leucine CH$NAME: Glycyl-leucine CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H16N2O3 CH$EXACT_MASS: 188.11609 CH$SMILES: NCC(=O)N[C@@H](CC(C)C)C(O)=O CH$IUPAC: InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t6-/m0/s1 CH$LINK: CAS 869-19-2 CH$LINK: KEGG C02155 CH$LINK: NIKKAJI J150.139I CH$LINK: PUBCHEM SID:5232
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 189 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-000i-0900000000-727fca50027e24ece915 PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 45.900 188119.0 2 86.200 1257427.0 10 111.100 44554.5 1 116.800 19802.0 1 124.700 49505.0 1 125.800 49505.0 1 128.600 148515.0 1 130.100 9901.0 1 132.100 14163380.5 114 138.900 39604.0 1 143.300 27232700.5 219 144.200 3762380.0 30 153.800 34653.5 1 157.100 366337.0 3 158.300 69307.0 1 171.200 8306939.0 67 172.300 712872.0 6 189.200 124356560.0 999 207.100 242574.5 2 405.300 29703.0 1 //