MassBank Record: PR010134



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

ACCESSION: PR010134
RECORD_TITLE: Ribitol; GC-EI-TOF; MS; 5 TMS; 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$NAME: Adonitol CH$NAME: Ribitol CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H12O5 CH$EXACT_MASS: 152.06847 CH$SMILES: OCC([H])(O)C([H])(O)C([H])(O)CO CH$IUPAC: InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5- CH$LINK: CAS 488-81-3 CH$LINK: CHEBI 15963 CH$LINK: KEGG C00474 CH$LINK: NIKKAJI J6.033J CH$LINK: PUBCHEM 3757
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$CHROMATOGRAPHY: RETENTION_INDEX 1710.9 AC$CHROMATOGRAPHY: RETENTION_TIME 416.034 sec
MS$FOCUSED_ION: BASE_PEAK 73 MS$FOCUSED_ION: DERIVATIVE_FORM C20H52O5Si5 MS$FOCUSED_ION: DERIVATIVE_MASS 512.26611 MS$FOCUSED_ION: DERIVATIVE_TYPE 5 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-8941000000-a1eac40beaba679b545b PK$NUM_PEAK: 118 PK$PEAK: m/z int. rel.int. 60 4 4 61 6 6 66 4 4 67 1 1 69 2 2 70 3 3 71 3 3 72 19 19 73 999 999 74 85 85 75 51 51 76 3 3 77 4 4 81 7 7 83 4 4 84 1 1 85 3 3 87 5 5 88 4 4 89 25 25 90 2 2 91 1 1 97 1 1 99 3 3 101 23 23 102 4 4 103 281 281 104 25 25 105 12 12 111 2 2 113 5 5 115 6 6 116 9 9 117 94 94 118 10 10 119 9 9 120 1 1 127 2 2 129 127 127 130 15 15 131 29 29 132 4 4 133 59 59 134 8 8 135 5 5 141 1 1 142 2 2 143 9 9 144 1 1 145 3 3 146 1 1 147 292 292 148 42 42 149 26 26 150 3 3 151 1 1 153 1 1 155 4 4 157 19 19 158 2 2 159 2 2 161 3 3 163 4 4 169 1 1 170 2 2 171 2 2 173 1 1 175 5 5 176 1 1 177 3 3 189 49 49 190 11 11 191 22 22 192 4 4 193 2 2 201 1 1 203 12 12 204 42 42 205 99 99 206 21 21 207 12 12 208 2 2 215 1 1 217 235 235 218 57 57 219 22 22 220 4 4 221 7 7 222 1 1 223 1 1 229 5 5 230 1 1 231 1 1 243 14 14 244 3 3 245 2 2 277 10 10 278 4 4 279 2 2 291 3 3 292 1 1 305 1 1 306 2 2 307 31 31 308 9 9 309 4 4 317 5 5 318 2 2 319 54 54 320 16 16 321 7 7 322 1 1 332 9 9 333 3 3 334 1 1 395 1 1 422 3 3 423 1 1 //