MassBank Record: OUF00232



 D-(+)-Fucose; GC-EI-TOF; MS; n TMS; RT:657.959 sec 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: OUF00232
RECORD_TITLE: D-(+)-Fucose; GC-EI-TOF; MS; n TMS; RT:657.959 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$NAME: D-(+)-Fucose CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H12O5 CH$EXACT_MASS: 164.06847 CH$SMILES: C[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)C(O)1 CH$IUPAC: InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m1/s1 CH$LINK: CAS 2438-80-4 CH$LINK: CHEBI 18287 48204 CH$LINK: CHEMSPIDER 2299091 CH$LINK: PUBCHEM 3034656 CH$LINK: INCHIKEY SHZGCJCMOBCMKK-SVZMEOIVSA-N
AC$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 1724.119 AC$CHROMATOGRAPHY: RETENTION_TIME 657.959 sec AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-014i-0910000000-9868780a714fa167ccc5 PK$NUM_PEAK: 117 PK$PEAK: m/z int. rel.int. 85 10 10 86 5 5 87 9 9 88 5 5 89 79 79 90 7 7 91 5 5 97 1 1 98 2 2 99 8 8 100 42 42 101 34 34 102 17 17 103 90 90 104 10 10 105 18 18 106 1 1 107 1 1 108 1 1 111 2 2 112 2 2 113 5 5 114 6 6 115 22 22 116 12 12 117 999 999 118 111 111 119 49 49 120 3 3 121 1 1 126 2 2 127 6 6 128 2 2 129 79 79 130 23 23 131 72 72 132 10 10 133 73 73 134 10 10 135 6 6 141 2 2 142 4 4 143 26 26 144 5 5 145 5 5 146 1 1 147 170 170 148 27 27 149 21 21 150 2 2 151 1 1 155 2 2 156 1 1 157 1 1 158 3 3 159 3 3 160 91 91 161 53 53 162 9 9 163 11 11 164 2 2 170 1 1 171 6 6 172 5 5 173 4 4 174 2 2 175 2 2 177 4 4 182 1 1 186 1 1 188 1 1 189 17 17 190 5 5 191 18 18 192 3 3 193 1 1 201 12 12 202 3 3 203 12 12 204 21 21 205 10 10 206 3 3 207 2 2 214 4 4 215 1 1 216 1 1 217 15 15 218 5 5 219 32 32 220 7 7 221 6 6 222 1 1 230 1 1 231 11 11 232 4 4 233 24 24 234 7 7 235 5 5 236 1 1 244 4 4 245 2 2 246 2 2 262 1 1 270 1 1 274 1 1 277 43 43 278 14 14 279 7 7 280 1 1 291 4 4 292 1 1 293 2 2 305 1 1 306 1 1 321 17 17 322 6 6 323 2 2 //