MassBank Record: OUF00315



 L-(+)-Lysine; GC-EI-TOF; MS; n TMS; RT:737.193 sec 
Mass Spectrum
Chemical Structure
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ACCESSION: OUF00315
RECORD_TITLE: L-(+)-Lysine; GC-EI-TOF; MS; n TMS; RT:737.193 sec
DATE: 2016.01.19 (2010.05.20, 2013.04.24)
AUTHORS: Tsujimoto Yengineering department, Osaka Univ., Tsugawa Hengineering department, Osaka Univ., Bamba Tengineering department, Osaka Univ., Fukusaki Eengineering department, Osaka Univ., engineering department, Osaka Univ.
LICENSE: CC BY-SA
COMMENT: The chemical compound was chemically modified with N-methyl-N-trimethylsilyl-trifluoroacetamide (MSTFA) before GC-MS analysis. When it has two or more functional groups, this modification gave a mixture of the TMS derivatives having different number of TMS groups at different functional groups.

CH$NAME: L-Lysine CH$NAME: L-(+)-Lysine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H14N2O2 CH$EXACT_MASS: 146.10553 CH$SMILES: NCCCC[C@H](N)C(O)=O CH$IUPAC: InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1 CH$LINK: CAS 56-87-1 CH$LINK: CHEBI 18019 CH$LINK: CHEMSPIDER 5747 CH$LINK: KEGG C00047 D02304 CH$LINK: PUBCHEM 5962 CH$LINK: INCHIKEY KDXKERNSBIXSRK-YFKPBYRVSA-N
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: HELIUM_FLOW 1 ml/min AC$MASS_SPECTROMETRY: ION_SOURCE_TEMPERATURE 200 C AC$MASS_SPECTROMETRY: SCAN_RANGE_M/Z 85-500 AC$CHROMATOGRAPHY: COLUMN_NAME CP-SIL 8 CB LOW BLEED/MS AC$CHROMATOGRAPHY: INJECTION_TEMPERATURE 230 C AC$CHROMATOGRAPHY: OVEN_TEMPERATURE 80 C (Duration 2 min)-330 C (rate: 15 C/min; Duration 6 min) AC$CHROMATOGRAPHY: RETENTION_INDEX 1911.787 AC$CHROMATOGRAPHY: RETENTION_TIME 737.193 sec AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-0ab9-1910000000-87ef8534f592041f50f2 PK$NUM_PEAK: 194 PK$PEAK: m/z int. rel.int. 85 34 34 86 322 322 87 44 44 88 153 153 89 19 19 90 11 11 91 1 1 92 4 4 93 3 3 94 13 13 95 4 4 96 5 5 97 9 9 98 31 31 99 23 23 100 322 322 101 51 51 102 97 97 103 42 42 104 9 9 105 4 4 108 2 2 109 2 2 110 9 9 111 6 6 112 77 77 113 24 24 114 89 89 115 117 117 116 45 45 117 57 57 118 14 14 119 13 13 120 2 2 121 1 1 123 2 2 124 9 9 125 3 3 126 34 34 127 11 11 128 352 352 129 60 60 130 134 134 131 80 80 132 56 56 133 76 76 134 15 15 135 6 6 136 1 1 138 8 8 139 5 5 140 67 67 141 16 16 142 48 48 143 13 13 144 16 16 145 7 7 146 78 78 147 244 244 148 48 48 149 25 25 150 6 6 151 16 16 152 5 5 153 2 2 154 73 73 155 39 39 156 999 999 157 155 155 158 68 68 159 13 13 160 26 26 161 8 8 162 6 6 163 1 1 164 4 4 165 1 1 166 15 15 167 10 10 168 14 14 169 5 5 170 13 13 171 5 5 172 40 40 173 11 11 174 848 848 175 160 160 176 76 76 177 11 11 178 2 2 181 1 1 182 4 4 183 2 2 184 10 10 185 5 5 186 33 33 187 10 10 188 13 13 189 9 9 190 5 5 191 19 19 192 3 3 193 1 1 196 1 1 198 4 4 199 3 3 200 87 87 201 20 20 202 31 31 203 9 9 204 7 7 205 2 2 206 1 1 207 1 1 212 8 8 213 10 10 214 31 31 215 14 14 216 17 17 217 10 10 218 36 36 219 16 16 220 12 12 221 5 5 222 3 3 223 1 1 224 1 1 225 1 1 226 2 2 227 5 5 228 58 58 229 19 19 230 182 182 231 41 41 232 21 21 233 4 4 234 1 1 235 1 1 236 1 1 239 3 3 240 7 7 241 3 3 242 3 3 243 4 4 244 6 6 245 2 2 246 3 3 247 1 1 248 2 2 249 1 1 250 1 1 252 1 1 253 1 1 254 2 2 255 6 6 256 4 4 257 3 3 258 7 7 259 2 2 260 4 4 261 1 1 262 1 1 263 1 1 271 1 1 272 10 10 273 12 12 274 6 6 275 2 2 301 1 1 302 2 2 304 1 1 305 1 1 316 5 5 317 190 190 318 70 70 319 31 31 320 8 8 321 1 1 329 19 19 330 9 9 331 3 3 332 1 1 362 1 1 391 3 3 392 2 2 393 1 1 419 5 5 420 2 2 421 1 1 433 2 2 434 17 17 435 10 10 436 5 5 437 1 1 //