MassBank Record: KZ000112



 Cadaverine; GC-EI-TOF; MS; 4 TMS; BP:174 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000112
RECORD_TITLE: Cadaverine; GC-EI-TOF; MS; 4 TMS; BP:174
DATE: 2016.01.19 (2009.03.11, 2011.05.06)
AUTHORS: Ara TKazusa DNA Research Institute, Morishita YKazusa DNA Research Institute, Shibata DKazusa DNA Research Institute, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_05426_P000045

CH$NAME: Cadaverine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H14N2 CH$EXACT_MASS: 102.11570 CH$SMILES: NCCCCCN CH$IUPAC: InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2 CH$LINK: CAS 462-94-2 CH$LINK: KEGG C01672 CH$LINK: INCHIKEY VHRGRCVQAFMJIZ-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID5075448
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME DB-17MS AC$CHROMATOGRAPHY: RETENTION_INDEX 0.0000 AC$CHROMATOGRAPHY: RETENTION_TIME 818.563 sec
MS$FOCUSED_ION: BASE_PEAK 174 MS$FOCUSED_ION: DERIVATIVE_TYPE 4 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-1900000000-c7101e746f630b0d4f42 PK$NUM_PEAK: 86 PK$PEAK: m/z int. rel.int. 84 2 2 85 7 7 86 188 188 87 6 6 88 28 28 97 1 1 98 2 2 99 6 6 100 100 100 101 5 5 102 16 16 112 40 40 113 4 4 114 12 12 115 5 5 116 5 5 117 4 4 118 1 1 124 2 2 126 9 9 127 1 1 128 8 8 129 2 2 130 52 52 131 18 18 132 12 12 138 3 3 139 1 1 140 17 17 141 2 2 142 4 4 143 3 3 144 4 4 145 2 2 146 22 22 147 3 3 154 10 10 155 2 2 156 9 9 157 1 1 158 19 19 159 2 2 160 25 25 161 3 3 162 1 1 170 2 2 171 1 1 172 18 18 173 3 3 174 999 999 175 112 112 176 47 47 177 4 4 180 3 3 184 4 4 185 1 1 186 35 35 187 7 7 188 8 8 189 2 2 198 5 5 199 1 1 200 29 29 201 6 6 202 4 4 204 1 1 212 6 6 213 5 5 214 11 11 215 1 1 216 11 11 217 1 1 218 1 1 227 2 2 228 6 6 229 28 28 230 7 7 231 2 2 244 1 1 374 4 4 375 28 28 376 8 8 377 2 2 378 1 1 379 2 2 391 1 1 //

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