MassBank Record: OUF00213



 D-Ribulose-5-phosphate; GC-EI-TOF; MS; n TMS; RT:807.735 sec 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: OUF00213
RECORD_TITLE: D-Ribulose-5-phosphate; GC-EI-TOF; MS; n TMS; RT:807.735 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$NAME: D-Ribulose-5-phosphate CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H11O8P CH$EXACT_MASS: 230.01915 CH$SMILES: OCC(=O)C(O)C(O)COP(O)(O)=O CH$IUPAC: InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h4-6,8-9H,1-2H2,(H2,10,11,12)/t4-,5+/m1/s1 CH$LINK: CAS 93-87-8 CH$LINK: CHEBI 52742 CH$LINK: CHEMSPIDER 388313 CH$LINK: KEGG C00117 CH$LINK: PUBCHEM 439167 CH$LINK: INCHIKEY FNZLKVNUWIIPSJ-UHNVWZDZSA-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$CHROMATOGRAPHY: RETENTION_INDEX 2094.806 AC$CHROMATOGRAPHY: RETENTION_TIME 807.735 sec AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-0a4j-1935000000-31be2cabeeebc480c1b8 PK$NUM_PEAK: 261 PK$PEAK: m/z int. rel.int. 85 36 36 86 19 19 87 27 27 88 19 19 89 296 296 90 29 29 91 22 22 92 4 4 93 8 8 94 6 6 95 6 6 96 10 10 97 4 4 98 20 20 99 27 27 100 43 43 101 259 259 102 37 37 103 300 300 104 33 33 105 61 61 106 8 8 107 11 11 108 1 1 109 5 5 110 3 3 111 9 9 112 8 8 113 32 32 114 142 142 115 61 61 116 87 87 117 62 62 118 11 11 119 46 46 120 6 6 121 19 19 122 2 2 123 8 8 124 2 2 125 7 7 126 30 30 127 14 14 128 36 36 129 220 220 130 38 38 131 73 73 132 16 16 133 284 284 134 41 41 135 80 80 136 9 9 137 29 29 138 5 5 139 5 5 140 15 15 141 8 8 142 28 28 143 29 29 144 9 9 145 10 10 146 3 3 147 437 437 148 74 74 149 57 57 150 9 9 151 32 32 152 15 15 153 10 10 154 21 21 155 8 8 156 21 21 157 12 12 158 13 13 159 7 7 160 3 3 161 3 3 162 1 1 163 21 21 164 3 3 165 11 11 166 8 8 167 17 17 168 47 47 169 14 14 170 10 10 171 3 3 172 17 17 173 31 31 174 39 39 175 10 10 176 3 3 177 11 11 178 2 2 179 10 10 180 2 2 181 43 43 182 12 12 183 21 21 184 22 22 185 6 6 186 10 10 187 5 5 188 8 8 189 15 15 190 4 4 191 45 45 192 11 11 193 42 42 194 9 9 195 54 54 196 11 11 197 22 22 198 24 24 199 6 6 200 14 14 201 8 8 202 10 10 203 6 6 204 7 7 205 10 10 206 2 2 207 67 67 208 17 17 209 16 16 210 6 6 211 219 219 212 40 40 213 24 24 214 17 17 215 9 9 216 17 17 217 90 90 218 27 27 219 11 11 220 2 2 221 7 7 222 2 2 223 3 3 224 1 1 225 70 70 226 18 18 227 37 37 228 24 24 229 9 9 230 16 16 231 8 8 232 3 3 233 1 1 237 1 1 239 1 1 240 13 13 241 15 15 242 23 23 243 16 16 244 12 12 245 4 4 246 1 1 247 1 1 253 34 34 254 8 8 255 11 11 256 27 27 257 28 28 258 19 19 259 7 7 260 3 3 261 3 3 262 27 27 263 10 10 264 3 3 267 2 2 268 1 1 269 20 20 270 4 4 271 3 3 272 5 5 273 2 2 274 3 3 276 1 1 281 1 1 283 15 15 284 6 6 285 20 20 286 6 6 287 4 4 288 15 15 289 4 4 290 4 4 291 1 1 297 1 1 298 11 11 299 285 285 300 93 93 301 48 48 302 13 13 303 3 3 304 1 1 305 1 1 311 1 1 313 8 8 314 10 10 315 92 92 316 32 32 317 18 18 318 6 6 319 2 2 327 1 1 328 12 12 329 4 4 330 5 5 331 23 23 332 12 12 333 5 5 340 3 3 341 58 58 342 37 37 343 15 15 344 4 4 345 3 3 346 6 6 347 10 10 348 5 5 349 3 3 350 2 2 351 1 1 352 1 1 353 2 2 354 2 2 355 5 5 356 43 43 357 999 999 358 322 322 359 162 162 360 38 38 361 10 10 362 22 22 363 9 9 364 4 4 370 3 3 371 5 5 372 3 3 373 10 10 374 4 4 375 1 1 377 1 1 378 25 25 379 10 10 380 5 5 381 1 1 386 4 4 387 45 45 388 21 21 389 18 18 390 5 5 391 1 1 408 1 1 429 3 3 430 1 1 431 1 1 482 1 1 //