MassBank Record: OUF00236



 D-(+)-Galactose; GC-EI-TOF; MS; n TMS; RT:730.094 sec 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: OUF00236
RECORD_TITLE: D-(+)-Galactose; GC-EI-TOF; MS; n TMS; RT:730.094 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$NAME: D-(+)-Galactose CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H12O6 CH$EXACT_MASS: 180.06339 CH$SMILES: OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)C(O)1 CH$IUPAC: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6?/m1/s1 CH$LINK: CAS 26566-61-0 CH$LINK: CHEBI 17118 CH$LINK: CHEMSPIDER 2301265 CH$LINK: PUBCHEM 3037556 CH$LINK: INCHIKEY WQZGKKKJIJFFOK-SVZMEOIVSA-N
AC$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 1894.099 AC$CHROMATOGRAPHY: RETENTION_TIME 730.094 sec AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-0ldj-0931000000-1ed532d5d2897be775df PK$NUM_PEAK: 188 PK$PEAK: m/z int. rel.int. 85 20 20 86 15 15 87 24 24 88 25 25 89 316 316 90 33 33 91 17 17 92 1 1 96 19 19 97 21 21 98 4 4 99 19 19 100 67 67 101 77 77 102 40 40 103 741 741 104 74 74 105 76 76 106 12 12 107 2 2 108 1 1 110 1 1 111 10 10 112 5 5 113 19 19 114 22 22 115 25 25 116 31 31 117 335 335 118 39 39 119 42 42 120 3 3 121 1 1 126 6 6 127 14 14 128 9 9 129 373 373 130 67 67 131 103 103 132 20 20 133 252 252 134 37 37 135 24 24 136 2 2 138 1 1 139 1 1 140 1 1 141 7 7 142 11 11 143 52 52 144 9 9 145 15 15 146 5 5 147 999 999 148 164 164 149 109 109 150 13 13 151 7 7 152 2 2 153 2 2 154 5 5 155 2 2 156 3 3 157 256 256 158 42 42 159 28 28 160 263 263 161 69 69 162 18 18 163 33 33 164 6 6 165 4 4 168 5 5 169 19 19 170 3 3 171 4 4 172 12 12 173 15 15 174 5 5 175 19 19 176 3 3 177 23 23 178 6 6 179 3 3 180 3 3 181 2 2 182 6 6 183 1 1 185 1 1 186 9 9 187 6 6 188 6 6 189 85 85 190 28 28 191 45 45 192 8 8 193 4 4 194 1 1 196 3 3 198 1 1 200 3 3 201 29 29 202 9 9 203 17 17 204 95 95 205 548 548 206 110 110 207 60 60 208 12 12 209 1 1 210 2 2 214 21 21 215 7 7 216 10 10 217 341 341 218 79 79 219 39 39 220 7 7 221 21 21 222 5 5 227 1 1 228 2 2 229 70 70 230 26 26 231 21 21 232 9 9 233 30 30 234 10 10 235 18 18 236 3 3 237 3 3 240 2 2 241 1 1 242 5 5 243 6 6 244 7 7 245 6 6 246 5 5 247 12 12 248 2 2 249 1 1 251 1 1 254 2 2 258 1 1 259 4 4 262 3 3 264 1 1 265 2 2 267 1 1 268 10 10 269 2 2 270 2 2 273 3 3 274 5 5 275 2 2 277 17 17 278 6 6 279 1 1 280 1 1 288 1 1 291 24 24 292 7 7 293 3 3 300 3 3 303 1 1 304 2 2 305 16 16 306 8 8 307 23 23 308 5 5 309 1 1 318 9 9 319 367 367 320 129 129 321 64 64 322 12 12 323 2 2 325 1 1 332 1 1 337 1 1 344 1 1 347 1 1 376 3 3 380 1 1 410 1 1 414 1 1 480 1 1 482 1 1 //