MassBank Record: KZ000273



 Uridine; GC-EI-TOF; MS; 3 TMS; BP:217 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000273
RECORD_TITLE: Uridine; GC-EI-TOF; MS; 3 TMS; BP:217
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_01688_P000142

CH$NAME: Uridine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C9H12N2O6 CH$EXACT_MASS: 244.06954 CH$SMILES: OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1N(C=2)C(=O)NC(=O)C2 CH$IUPAC: InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1 CH$LINK: CAS 58-96-8 CH$LINK: KEGG C00299 CH$LINK: INCHIKEY DRTQHJPVMGBUCF-XVFCMESISA-N CH$LINK: COMPTOX DTXSID40891555
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 2605.7 AC$CHROMATOGRAPHY: RETENTION_TIME 1137.76 sec
MS$FOCUSED_ION: BASE_PEAK 217 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00kb-1970000000-d1bfa838a4e9fa77c862 PK$NUM_PEAK: 281 PK$PEAK: m/z int. rel.int. 82 41 41 83 28 28 84 23 23 85 63 63 86 36 36 87 34 34 88 12 12 89 85 85 90 10 10 91 5 5 92 8 8 93 5 5 94 12 12 95 18 18 96 51 51 97 42 42 98 35 35 99 378 378 100 233 233 101 169 169 102 75 75 103 467 467 104 48 48 105 31 31 106 5 5 107 3 3 108 7 7 109 15 15 110 16 16 111 45 45 112 22 22 113 105 105 114 23 23 115 104 104 116 65 65 117 145 145 118 18 18 119 32 32 120 8 8 121 4 4 122 4 4 123 5 5 124 13 13 125 18 18 126 68 68 127 44 44 128 19 19 129 242 242 130 68 68 131 131 131 132 28 28 133 238 238 134 35 35 135 28 28 136 6 6 137 4 4 138 13 13 139 10 10 140 56 56 141 38 38 142 41 41 143 143 143 144 25 25 145 67 67 146 10 10 147 881 881 148 186 186 149 130 130 150 22 22 151 11 11 152 8 8 153 84 84 154 36 36 155 38 38 156 26 26 157 48 48 158 12 12 159 19 19 160 5 5 161 6 6 162 2 2 163 23 23 164 4 4 165 3 3 166 6 6 167 94 94 168 109 109 169 601 601 170 95 95 171 61 61 172 9 9 173 16 16 174 16 16 175 12 12 176 3 3 177 14 14 178 3 3 179 3 3 180 3 3 181 7 7 182 9 9 183 60 60 184 22 22 185 115 115 186 18 18 187 10 10 188 3 3 189 31 31 190 8 8 191 85 85 192 19 19 193 14 14 194 4 4 195 5 5 196 135 135 197 27 27 198 9 9 199 6 6 200 2 2 201 10 10 202 6 6 203 28 28 204 25 25 205 10 10 206 3 3 207 9 9 208 5 5 209 25 25 210 8 8 211 6 6 212 3 3 213 9 9 214 4 4 215 67 67 216 25 25 217 999 999 218 290 290 219 108 108 220 20 20 221 11 11 222 4 4 223 8 8 224 400 400 225 74 74 226 24 24 227 8 8 228 3 3 229 17 17 230 70 70 231 35 35 232 12 12 233 4 4 234 1 1 235 3 3 236 2 2 237 3 3 238 3 3 239 7 7 240 10 10 241 320 320 242 82 82 243 447 447 244 117 117 245 534 534 246 119 119 247 49 49 248 9 9 249 4 4 250 2 2 251 3 3 252 3 3 253 3 3 254 3 3 255 44 44 256 38 38 257 349 349 258 461 461 259 218 218 260 64 64 261 20 20 262 4 4 263 11 11 264 2 2 265 1 1 267 1 1 268 1 1 269 4 4 270 5 5 271 3 3 272 2 2 273 1 1 274 1 1 275 1 1 276 1 1 281 1 1 282 2 2 283 20 20 284 8 8 285 31 31 286 30 30 287 14 14 288 5 5 289 2 2 290 1 1 291 2 2 292 1 1 296 1 1 297 3 3 298 4 4 299 23 23 300 6 6 301 3 3 303 1 1 304 1 1 305 1 1 309 2 2 310 4 4 311 24 24 312 8 8 313 22 22 314 47 47 315 165 165 316 43 43 317 17 17 318 5 5 319 5 5 320 3 3 321 1 1 322 1 1 323 9 9 324 3 3 325 2 2 326 2 2 327 2 2 328 1 1 329 4 4 330 4 4 331 4 4 332 1 1 333 4 4 334 1 1 337 4 4 338 2 2 339 11 11 340 2 2 341 1 1 347 7 7 348 60 60 349 20 20 350 9 9 351 3 3 352 5 5 353 2 2 358 1 1 359 2 2 370 4 4 371 16 16 372 7 7 373 3 3 374 1 1 385 1 1 386 7 7 387 14 14 388 5 5 389 1 1 399 1 1 400 1 1 401 5 5 402 1 1 413 1 1 414 4 4 415 3 3 416 1 1 427 3 3 428 2 2 429 4 4 430 1 1 441 1 1 442 5 5 443 2 2 444 1 1 //

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