ACCESSION: MSBNK-Kazusa-KZ000201
RECORD_TITLE: D-(+)-Galactosamine; GC-EI-TOF; MS; 5 TMS; BP:159
DATE: 2016.01.19 (Created 2009.03.11, modified 2011.05.06)
AUTHORS: Ara T, Morishita Y, Shibata D, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01463_P000061

CH$NAME: D-Galactosamine
CH$NAME: D-(+)-Galactosamine
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C₆H₁₃NO₅
CH$EXACT_MASS: 179.07937
CH$SMILES: O=CC(N)C(O)C(O)C(O)CO
CH$IUPAC: InChI=1S/C6H13NO5/c7-3(1-8)5(11)6(12)4(10)2-9/h1,3-6,9-12H,2,7H2/t3-,4+,5+,6-/m0/s1
CH$LINK: CAS 7535-00-4
CH$LINK: KEGG C02262
CH$LINK: INCHIKEY FZHXIRIBWMQPQF-KCDKBNATSA-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 1871.6
AC$CHROMATOGRAPHY: RETENTION_TIME 866.812 sec

MS$FOCUSED_ION: BASE_PEAK 159
MS$FOCUSED_ION: DERIVATIVE_TYPE 5 TMS
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)

PK$SPLASH: splash10-0a4i-1920000000-cb81e3806911f60bb184
PK$NUM_PEAK: 224
PK$PEAK: m/z int. rel.int.
  82 6 6
  83 21 21
  84 35 35
  85 13 13
  86 36 36
  87 24 24
  88 13 13
  89 204 204
  90 20 20
  91 9 9
  92 1 1
  93 2 2
  94 1 1
  95 2 2
  96 4 4
  97 5 5
  98 8 8
  99 16 16
  100 62 62
  101 68 68
  102 29 29
  103 260 260
  104 28 28
  105 23 23
  106 3 3
  107 2 2
  108 1 1
  109 1 1
  110 4 4
  111 7 7
  112 7 7
  113 42 42
  114 12 12
  115 16 16
  116 20 20
  117 171 171
  118 21 21
  119 16 16
  120 2 2
  121 1 1
  123 1 1
  124 2 2
  125 3 3
  126 7 7
  127 20 20
  128 30 30
  129 171 171
  130 37 37
  131 63 63
  132 18 18
  133 84 84
  134 12 12
  135 7 7
  136 1 1
  137 3 3
  138 1 1
  139 2 2
  140 4 4
  141 19 19
  142 19 19
  143 32 32
  144 18 18
  145 7 7
  146 9 9
  147 460 460
  148 75 75
  149 45 45
  150 6 6
  151 3 3
  152 3 3
  153 5 5
  154 4 4
  155 3 3
  156 4 4
  157 82 82
  158 17 17
  159 999 999
  160 132 132
  161 45 45
  162 6 6
  163 9 9
  164 2 2
  165 3 3
  166 1 1
  167 3 3
  168 12 12
  169 5 5
  170 4 4
  171 6 6
  172 9 9
  173 6 6
  174 3 3
  175 7 7
  176 2 2
  177 4 4
  178 1 1
  179 2 2
  180 1 1
  181 1 1
  182 1 1
  183 1 1
  184 1 1
  185 5 5
  186 4 4
  187 3 3
  188 7 7
  189 33 33
  190 13 13
  191 12 12
  192 3 3
  193 1 1
  195 3 3
  196 1 1
  197 1 1
  198 1 1
  199 4 4
  200 6 6
  201 14 14
  202 5 5
  203 18 18
  204 45 45
  205 220 220
  206 46 46
  207 22 22
  208 4 4
  209 2 2
  210 1 1
  211 1 1
  212 1 1
  213 4 4
  214 7 7
  215 12 12
  216 23 23
  217 126 126
  218 27 27
  219 12 12
  220 2 2
  221 6 6
  222 2 2
  223 1 1
  226 1 1
  227 4 4
  228 3 3
  229 29 29
  230 10 10
  231 13 13
  232 15 15
  233 8 8
  234 3 3
  235 1 1
  239 1 1
  240 5 5
  241 4 4
  242 6 6
  243 7 7
  244 6 6
  245 3 3
  246 2 2
  247 2 2
  248 1 1
  251 1 1
  253 1 1
  255 2 2
  256 1 1
  257 1 1
  258 2 2
  259 1 1
  260 1 1
  261 3 3
  262 1 1
  263 1 1
  267 5 5
  268 2 2
  269 1 1
  272 1 1
  273 45 45
  274 11 11
  275 5 5
  276 1 1
  277 6 6
  278 4 4
  279 1 1
  285 1 1
  287 1 1
  288 1 1
  289 1 1
  290 2 2
  291 8 8
  292 3 3
  293 1 1
  302 1 1
  303 8 8
  304 7 7
  305 6 6
  306 3 3
  307 4 4
  308 1 1
  309 1 1
  314 1 1
  315 1 1
  316 2 2
  317 1 1
  318 6 6
  319 100 100
  320 32 32
  321 15 15
  322 3 3
  323 1 1
  329 1 1
  330 1 1
  331 1 1
  332 2 2
  333 1 1
  334 1 1
  342 1 1
  343 1 1
  357 3 3
  358 1 1
  359 1 1
  375 1 1
  447 3 3
  448 1 1
  449 1 1
  463 1 1
//