MassBank Record: KZ000187

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D-(-)-Mannitol; GC-EI-TOF; MS; 6 TMS; BP:147
Mass Spectrum
Chemical Structure
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ACCESSION: KZ000187
RECORD_TITLE: D-(-)-Mannitol; GC-EI-TOF; MS; 6 TMS; BP:147
DATE: 2016.01.19 (2009.03.11, 2011.05.06)
AUTHORS: Ara T, Morishita Y, Shibata D, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01472_P000047

CH$NAME: D-(-)-Mannitol CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H14O6 CH$EXACT_MASS: 182.07904 CH$SMILES: OCC([H])(O)C([H])(O)C([H])(O)C([H])(O)CO CH$IUPAC: InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1 CH$LINK: CAS 69-65-8 CH$LINK: KEGG C00392 CH$LINK: INCHIKEY FBPFZTCFMRRESA-KVTDHHQDSA-N CH$LINK: COMPTOX DTXSID1023235
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 1803.1 AC$CHROMATOGRAPHY: RETENTION_TIME 837.563 sec
MS$FOCUSED_ION: BASE_PEAK 147 MS$FOCUSED_ION: DERIVATIVE_TYPE 6 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0ktb-0931000000-b481d576c5f24dd1b1d5 PK$NUM_PEAK: 188 PK$PEAK: m/z int. rel.int. 82 1 1 83 37 37 84 6 6 85 13 13 86 4 4 87 25 25 88 18 18 89 104 104 90 10 10 91 5 5 92 1 1 93 1 1 94 1 1 95 2 2 96 1 1 97 17 17 98 2 2 99 14 14 100 2 2 101 85 85 102 17 17 103 670 670 104 67 67 105 34 34 106 2 2 107 1 1 108 1 1 109 1 1 111 10 10 112 2 2 113 17 17 114 3 3 115 20 20 116 24 24 117 355 355 118 37 37 119 30 30 120 3 3 121 2 2 125 2 2 126 1 1 127 8 8 128 2 2 129 261 261 130 34 34 131 88 88 132 14 14 133 168 168 134 24 24 135 15 15 136 1 1 137 1 1 139 1 1 140 1 1 141 6 6 142 4 4 143 39 39 144 5 5 145 10 10 146 3 3 147 999 999 148 165 165 149 101 101 150 11 11 151 5 5 152 1 1 153 2 2 154 1 1 155 10 10 156 3 3 157 166 166 158 22 22 159 13 13 160 2 2 161 7 7 162 1 1 163 13 13 164 2 2 165 1 1 167 2 2 168 1 1 169 8 8 170 2 2 171 1 1 172 1 1 173 3 3 174 1 1 175 17 17 176 3 3 177 8 8 178 1 1 179 1 1 180 1 1 181 1 1 182 1 1 183 16 16 184 3 3 185 2 2 186 1 1 187 2 2 188 1 1 189 84 84 190 22 22 191 64 64 192 12 12 193 6 6 194 1 1 201 5 5 202 2 2 203 12 12 204 101 101 205 458 458 206 94 94 207 50 50 208 8 8 209 2 2 215 4 4 216 2 2 217 384 384 218 85 85 219 38 38 220 6 6 221 26 26 222 6 6 223 3 3 224 1 1 229 47 47 230 16 16 231 31 31 232 7 7 233 3 3 234 1 1 237 1 1 239 2 2 243 4 4 244 1 1 245 1 1 246 1 1 247 2 2 248 1 1 249 1 1 255 15 15 256 4 4 257 5 5 258 1 1 259 8 8 260 2 2 261 1 1 263 1 1 265 4 4 266 1 1 273 1 1 277 17 17 278 9 9 279 4 4 280 1 1 290 1 1 291 17 17 292 5 5 293 3 3 304 1 1 305 16 16 306 10 10 307 48 48 308 15 15 309 7 7 310 1 1 317 1 1 318 12 12 319 304 304 320 95 95 321 46 46 322 10 10 323 2 2 329 1 1 330 1 1 331 15 15 332 4 4 333 2 2 344 1 1 345 13 13 346 4 4 347 2 2 419 4 4 420 3 3 421 7 7 422 3 3 423 1 1 //