MassBank Record: KZ000016



 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: KZ000016
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_01442_P000117

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 1754.1 AC$CHROMATOGRAPHY: RETENTION_TIME 815.628 sec
MS$FOCUSED_ION: BASE_PEAK 174 MS$FOCUSED_ION: DERIVATIVE_TYPE 4 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-2900000000-c1c59035a5dd2cf2397a PK$NUM_PEAK: 101 PK$PEAK: m/z int. rel.int. 82 2 2 83 3 3 84 13 13 85 20 20 86 331 331 87 36 36 88 36 36 89 3 3 90 1 1 95 1 1 96 1 1 97 4 4 98 14 14 99 16 16 100 157 157 101 29 29 102 33 33 103 7 7 104 2 2 106 1 1 110 2 2 111 1 1 112 41 41 113 16 16 114 22 22 115 15 15 116 25 25 117 24 24 118 6 6 119 1 1 124 3 3 125 1 1 126 10 10 127 2 2 128 13 13 129 7 7 130 91 91 131 41 41 132 19 19 133 4 4 134 1 1 138 3 3 139 1 1 140 17 17 141 3 3 142 11 11 143 5 5 144 7 7 145 2 2 146 24 24 147 4 4 148 2 2 154 11 11 155 3 3 156 10 10 157 2 2 158 31 31 159 6 6 160 19 19 161 3 3 162 1 1 170 4 4 171 1 1 172 27 27 173 6 6 174 999 999 175 193 193 176 84 84 177 10 10 178 2 2 180 2 2 184 3 3 185 1 1 186 39 39 187 8 8 188 8 8 189 1 1 190 1 1 198 3 3 199 1 1 200 15 15 201 4 4 202 3 3 212 3 3 213 3 3 214 6 6 215 1 1 216 7 7 217 1 1 218 1 1 227 4 4 228 3 3 229 14 14 230 4 4 231 1 1 374 3 3 375 22 22 376 9 9 377 4 4 378 1 1 390 1 1 //

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