MassBank Record: KO009015



 Kanamycin; LC-ESI-IT; MS3; m/z: 485/324; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO009015
RECORD_TITLE: Kanamycin; LC-ESI-IT; MS3; m/z: 485/324; [M+H]+
DATE: 2012.10.22 (2008.05.12)
AUTHORS: Ojima YInstitute for Advanced Biosciences, Keio Univ., Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., Soga TInstitute for Advanced Biosciences, Keio Univ., Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID K002
COMMENT: [MS2] KO009014

CH$NAME: Kanamycin CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H36N4O11 CH$EXACT_MASS: 484.23806 CH$SMILES: NCC(O1)C(O)C(O)C(O)C1OC(C(N)3)C(O)C(C(N)C3)OC(O2)C(O)C(N)C(O)C(CO)2 CH$IUPAC: InChI=1S/C18H36N4O11/c19-2-6-10(25)12(27)13(28)18(30-6)33-16-5(21)1-4(20)15(14(16)29)32-17-11(26)8(22)9(24)7(3-23)31-17/h4-18,23-29H,1-3,19-22H2/t4-,5+,6-,7-,8+,9-,10-,11-,12+,13-,14-,15+,16-,17-,18-/m1/s1 CH$LINK: CAS 25389-94-0 CH$LINK: KEGG C08046 CH$LINK: PUBCHEM 10246 CH$LINK: INCHIKEY SBUJHOSQTJFQJX-NOAMYHISSA-N
AC$INSTRUMENT: LC/MSD Trap XCT, Agilent Technologies AC$INSTRUMENT_TYPE: LC-ESI-IT AC$MASS_SPECTROMETRY: MS_TYPE MS3 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 0.60/0.60
MS$FOCUSED_ION: PRECURSOR_M/Z 485/324 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+ MS$DATA_PROCESSING: WHOLE LC/MSD Trap Control and Data Analysis
PK$SPLASH: splash10-03di-0900000000-4f1befc5fa2486f3bb6d PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 92.3 2.00 1 99.2 12.00 4 102.0 36.42 14 109.0 5.16 2 110.1 12.50 5 128.0 10.00 4 134.1 17.08 6 144.0 37.07 14 145.1 153.40 57 146.1 16.41 6 148.0 5.17 2 162.1 139.92 52 163.1 2694.49 999 170.1 0.83 1 187.1 63.16 23 204.1 1.67 1 205.1 320.15 119 305.1 25.07 9 306.0 3.67 1 307.0 1.58 1 324.2 139.75 52 348.4 1.25 1 516.7 2.08 1 //