MassBank Record: KZ000218



 L-(-)-Arabitol; GC-EI-TOF; MS; 5 TMS; BP:103 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000218
RECORD_TITLE: L-(-)-Arabitol; GC-EI-TOF; MS; 5 TMS; BP:103
DATE: 2016.01.19 (2009.03.11, 2011.05.06)
AUTHORS: Ara TKazusa DNA Research Institute, Morishita YKazusa DNA Research Institute, Shibata DKazusa DNA Research Institute, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01547_P000031

CH$NAME: L-(-)-Arabitol CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H12O5 CH$EXACT_MASS: 152.06847 CH$SMILES: OC[C@H](O)[C@H](O)[C@@H](O)CO CH$IUPAC: InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m0/s1 CH$LINK: CAS 7643-75-6 CH$LINK: KEGG C00532 CH$LINK: INCHIKEY HEBKCHPVOIAQTA-IMJSIDKUSA-N
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME DB-17MS AC$CHROMATOGRAPHY: RETENTION_INDEX 1638.0 AC$CHROMATOGRAPHY: RETENTION_TIME 762.013 sec
MS$FOCUSED_ION: BASE_PEAK 103 MS$FOCUSED_ION: DERIVATIVE_TYPE 5 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0uxs-0930000000-6ef7d2f1643b576f6fbf PK$NUM_PEAK: 155 PK$PEAK: m/z int. rel.int. 82 2 2 83 12 12 84 5 5 85 15 15 86 5 5 87 29 29 88 22 22 89 100 100 90 10 10 91 5 5 92 1 1 93 1 1 94 3 3 95 2 2 96 1 1 97 4 4 98 2 2 99 17 17 100 3 3 101 110 110 102 19 19 103 999 999 104 100 100 105 48 48 106 3 3 107 1 1 109 1 1 111 13 13 112 2 2 113 20 20 114 3 3 115 26 26 116 40 40 117 322 322 118 35 35 119 31 31 120 3 3 121 1 1 125 2 2 126 1 1 127 7 7 128 2 2 129 384 384 130 48 48 131 103 103 132 16 16 133 195 195 134 27 27 135 17 17 136 2 2 137 1 1 141 3 3 142 4 4 143 27 27 144 4 4 145 11 11 146 3 3 147 863 863 148 143 143 149 88 88 150 10 10 151 4 4 152 1 1 153 4 4 154 1 1 155 12 12 156 2 2 157 44 44 158 6 6 159 7 7 160 1 1 161 7 7 162 1 1 163 11 11 164 2 2 165 1 1 169 2 2 170 4 4 171 6 6 172 1 1 173 3 3 174 1 1 175 20 20 176 4 4 177 12 12 178 2 2 179 1 1 185 1 1 187 2 2 188 1 1 189 105 105 190 26 26 191 67 67 192 12 12 193 6 6 194 1 1 201 2 2 202 1 1 203 35 35 204 105 105 205 237 237 206 50 50 207 30 30 208 5 5 209 2 2 215 2 2 216 3 3 217 532 532 218 132 132 219 57 57 220 10 10 221 22 22 222 5 5 223 3 3 224 1 1 229 11 11 230 3 3 231 4 4 232 1 1 242 2 2 243 41 41 244 10 10 245 6 6 246 1 1 247 1 1 249 1 1 263 1 1 265 1 1 277 30 30 278 13 13 279 6 6 280 1 1 291 10 10 292 4 4 293 2 2 305 4 4 306 10 10 307 99 99 308 33 33 309 15 15 310 3 3 317 14 14 318 8 8 319 92 92 320 29 29 321 13 13 322 3 3 331 1 1 332 12 12 333 4 4 334 2 2 395 3 3 396 1 1 422 2 2 423 1 1 //