MassBank Record: PR010032



 D-(+)-Glucose; GC-EI-TOF; MS; 5 TMS; 1 MEOX; BP:73 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PR010032
RECORD_TITLE: D-(+)-Glucose; GC-EI-TOF; MS; 5 TMS; 1 MEOX; BP:73
DATE: 2016.01.19 (Created 2006.12.21, modified 2011.05.06)
AUTHORS: Kusano M, Fukushima A, Plant Science Center, RIKEN.
LICENSE: CC BY-SA

CH$NAME: D-(+)-Glucose CH$NAME: Grape sugar CH$NAME: Dextrose CH$NAME: D-Glucose 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 50-99-7 CH$LINK: CHEBI 17634 CH$LINK: KEGG C00031 CH$LINK: NIKKAJI J4.109B CH$LINK: PUBCHEM 3333
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$CHROMATOGRAPHY: RETENTION_INDEX 1902.6 AC$CHROMATOGRAPHY: RETENTION_TIME 463.786 sec
MS$FOCUSED_ION: BASE_PEAK 73 MS$FOCUSED_ION: DERIVATIVE_FORM C22H55NO6Si5 MS$FOCUSED_ION: DERIVATIVE_MASS 569.28757 MS$FOCUSED_ION: DERIVATIVE_TYPE 5 TMS; 1 MEOX MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-9621000000-9d1d8057758d3da8caca PK$NUM_PEAK: 132 PK$PEAK: m/z int. rel.int. 60 4 4 61 5 5 66 4 4 67 2 2 69 2 2 70 3 3 71 3 3 72 15 15 73 999 999 74 83 83 75 55 55 76 4 4 77 3 3 81 1 1 82 2 2 83 12 12 84 2 2 85 3 3 86 2 2 87 4 4 88 3 3 89 58 58 90 5 5 91 2 2 96 2 2 97 3 3 98 1 1 99 2 2 100 13 13 101 12 12 102 7 7 103 155 155 104 15 15 105 16 16 106 2 2 111 1 1 113 3 3 114 3 3 115 4 4 116 4 4 117 60 60 118 6 6 119 7 7 126 1 1 127 2 2 128 1 1 129 80 80 130 13 13 131 20 20 132 3 3 133 54 54 134 7 7 135 4 4 141 1 1 142 1 1 143 9 9 144 1 1 145 2 2 146 1 1 147 201 201 148 32 32 149 19 19 150 2 2 151 1 1 154 1 1 157 56 56 158 8 8 159 5 5 160 81 81 161 17 17 162 4 4 163 6 6 164 1 1 169 3 3 172 2 2 173 2 2 174 1 1 175 3 3 177 5 5 178 1 1 186 2 2 187 1 1 188 1 1 189 17 17 190 5 5 191 8 8 192 1 1 201 5 5 202 1 1 203 2 2 204 16 16 205 127 127 206 25 25 207 13 13 208 1 1 214 3 3 215 1 1 216 1 1 217 52 52 218 11 11 219 5 5 220 1 1 221 3 3 229 15 15 230 4 4 231 4 4 232 1 1 233 8 8 234 2 2 235 4 4 242 1 1 243 1 1 244 1 1 245 1 1 246 1 1 247 1 1 268 1 1 273 1 1 274 1 1 277 3 3 278 1 1 291 4 4 292 1 1 300 1 1 305 3 3 306 1 1 307 3 3 318 2 2 319 94 94 320 29 29 321 14 14 322 2 2 //