MassBank Record: KZ000033



 Guanosine; GC-EI-TOF; MS; 5 TMS; BP:103 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000033
RECORD_TITLE: Guanosine; GC-EI-TOF; MS; 5 TMS; BP:103
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_01516_P000059

CH$NAME: Guanosine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C10H13N5O5 CH$EXACT_MASS: 283.091669 CH$SMILES: C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(NC2=O)N CH$IUPAC: InChI=1S/C10H13N5O5/c11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)/t3-,5-,6-,9-/m1/s1 CH$LINK: CAS 118-00-3 CH$LINK: CHEBI 16750 CH$LINK: CHEMSPIDER 6544 CH$LINK: COMPTOX DTXSID00893055 CH$LINK: INCHIKEY NYHBQMYGNKIUIF-UUOKFMHZSA-N CH$LINK: KAPPAVIEW KPC00589 CH$LINK: KEGG C00387 CH$LINK: KNAPSACK C00019679 CH$LINK: NIKKAJI J10.076E CH$LINK: PUBCHEM CID:135398635
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 2929.7 AC$CHROMATOGRAPHY: RETENTION_TIME 1226.81 sec
MS$FOCUSED_ION: BASE_PEAK 103 MS$FOCUSED_ION: DERIVATIVE_TYPE 5 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0f7k-1952000000-c57c052c65f3fa9504af PK$NUM_PEAK: 365 PK$PEAK: m/z int. rel.int. 82 9 9 83 20 20 84 100 100 85 67 67 86 40 40 87 44 44 88 17 17 89 104 104 90 11 11 91 9 9 92 18 18 93 10 10 94 9 9 95 17 17 96 10 10 97 47 47 98 28 28 99 176 176 100 91 91 101 144 144 102 40 40 103 999 999 104 102 102 105 57 57 106 9 9 107 12 12 108 6 6 109 9 9 110 23 23 111 62 62 112 19 19 113 64 64 114 18 18 115 226 226 116 67 67 117 199 199 118 30 30 119 35 35 120 7 7 121 6 6 122 6 6 123 9 9 124 13 13 125 22 22 126 26 26 127 36 36 128 15 15 129 246 246 130 55 55 131 187 187 132 56 56 133 208 208 134 63 63 135 26 26 136 11 11 137 9 9 138 24 24 139 14 14 140 16 16 141 50 50 142 35 35 143 117 117 144 33 33 145 42 42 146 79 79 147 837 837 148 140 140 149 100 100 150 19 19 151 13 13 152 14 14 153 37 37 154 12 12 155 22 22 156 18 18 157 92 92 158 73 73 159 25 25 160 12 12 161 6 6 162 8 8 163 10 10 164 12 12 165 30 30 166 87 87 167 22 22 168 18 18 169 160 160 170 30 30 171 97 97 172 27 27 173 34 34 174 10 10 175 11 11 176 10 10 177 10 10 178 9 9 179 9 9 180 23 23 181 12 12 182 17 17 183 9 9 184 7 7 185 5 5 186 3 3 187 12 12 188 8 8 189 71 71 190 49 49 191 47 47 192 22 22 193 14 14 194 12 12 195 7 7 196 7 7 197 8 8 198 16 16 199 6 6 200 3 3 201 5 5 202 3 3 203 9 9 204 16 16 205 19 19 206 25 25 207 24 24 208 52 52 209 13 13 210 14 14 211 5 5 212 4 4 213 2 2 214 2 2 215 16 16 216 7 7 217 248 248 218 60 60 219 36 36 220 14 14 221 16 16 222 19 19 223 15 15 224 10 10 225 5 5 226 2 2 227 2 2 228 1 1 229 18 18 230 246 246 231 77 77 232 39 39 233 10 10 234 13 13 235 5 5 236 12 12 237 12 12 238 26 26 239 12 12 240 6 6 241 3 3 242 3 3 243 191 191 244 54 54 245 515 515 246 118 118 247 51 51 248 16 16 249 7 7 250 9 9 251 18 18 252 10 10 253 6 6 254 3 3 255 2 2 256 2 2 257 10 10 258 12 12 259 87 87 260 22 22 261 10 10 262 9 9 263 10 10 264 125 125 265 35 35 266 20 20 267 7 7 268 3 3 269 1 1 270 1 1 271 1 1 272 1 1 273 1 1 274 2 2 275 1 1 276 5 5 277 7 7 278 39 39 279 53 53 280 504 504 281 153 153 282 63 63 283 14 14 284 3 3 285 1 1 286 2 2 287 2 2 288 2 2 289 2 2 290 4 4 291 5 5 292 12 12 293 12 12 294 77 77 295 103 103 296 131 131 297 41 41 298 14 14 299 4 4 300 2 2 301 1 1 302 2 2 303 1 1 304 4 4 305 4 4 306 11 11 307 7 7 308 32 32 309 14 14 310 6 6 311 2 2 312 1 1 313 1 1 314 2 2 315 2 2 316 2 2 317 2 2 318 4 4 319 6 6 320 16 16 321 10 10 322 12 12 323 51 51 324 613 613 325 168 168 326 68 68 327 13 13 328 4 4 329 1 1 330 1 1 331 2 2 332 2 2 333 5 5 334 5 5 335 4 4 336 8 8 337 5 5 338 5 5 339 2 2 340 1 1 344 1 1 345 1 1 346 2 2 347 3 3 348 17 17 349 6 6 350 7 7 351 10 10 352 55 55 353 24 24 354 13 13 355 3 3 356 1 1 357 1 1 358 1 1 359 1 1 360 1 1 361 2 2 362 2 2 363 1 1 364 1 1 365 3 3 366 14 14 367 33 33 368 145 145 369 54 54 370 25 25 371 7 7 372 2 2 373 1 1 374 1 1 375 1 1 376 1 1 377 1 1 378 3 3 379 2 2 380 5 5 381 3 3 382 3 3 383 2 2 384 1 1 391 1 1 392 3 3 393 16 16 394 73 73 395 30 30 396 17 17 397 6 6 398 2 2 399 1 1 400 1 1 405 1 1 406 1 1 407 2 2 408 8 8 409 28 28 410 90 90 411 37 37 412 16 16 413 4 4 414 1 1 420 1 1 421 4 4 422 17 17 423 8 8 424 8 8 425 18 18 426 8 8 427 4 4 428 2 2 434 2 2 435 2 2 436 1 1 437 1 1 438 1 1 439 1 1 442 1 1 443 1 1 446 1 1 447 1 1 448 3 3 449 2 2 450 3 3 451 1 1 452 1 1 453 1 1 454 1 1 462 1 1 463 2 2 464 4 4 465 2 2 466 2 2 467 1 1 468 1 1 480 1 1 481 3 3 482 6 6 483 4 4 484 3 3 485 1 1 486 1 1 494 1 1 495 1 1 496 1 1 497 1 1 499 1 1 //

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