MassBank Record: MSBNK-Osaka_Univ-OUF00340
ACCESSION: MSBNK-Osaka_Univ-OUF00340
RECORD_TITLE: D-(+)-Maltose; GC-EI-TOF; MS; n TMS; RT:1007.440 sec
DATE: 2016.01.19 (Created 2010.05.20, modified 2013.04.24)
AUTHORS: Tsujimoto Y, Tsugawa H, Bamba T, Fukusaki E, 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$NAME: Maltose
CH$NAME: D-(+)-Maltose
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C12H22O11
CH$EXACT_MASS: 342.11621
CH$SMILES: OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)C(O)O2
CH$IUPAC: InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11?,12-/m1/s1
CH$LINK: CAS
69-79-4
CH$LINK: CHEMSPIDER
23936499
CH$LINK: INCHIKEY
GUBGYTABKSRVRQ-PICCSMPSSA-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$CHROMATOGRAPHY: RETENTION_INDEX 2706.831
AC$CHROMATOGRAPHY: RETENTION_TIME 1007.440 sec
AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-0uxs-0942000000-c3c096cbb3df4476c9e2
PK$NUM_PEAK: 295
PK$PEAK: m/z int. rel.int.
85 25 25
86 14 14
87 22 22
88 16 16
89 210 210
90 20 20
91 13 13
92 3 3
93 3 3
94 4 4
95 7 7
96 6 6
97 31 31
98 9 9
99 24 24
100 51 51
101 75 75
102 42 42
103 593 593
104 60 60
105 82 82
106 11 11
107 6 6
108 2 2
109 26 26
110 7 7
111 19 19
112 8 8
113 33 33
114 30 30
115 36 36
116 39 39
117 408 408
118 43 43
119 34 34
120 5 5
121 3 3
122 1 1
123 1 1
124 2 2
125 5 5
126 7 7
127 24 24
128 14 14
129 459 459
130 78 78
131 107 107
132 21 21
133 229 229
134 32 32
135 20 20
136 3 3
137 2 2
138 5 5
139 12 12
140 7 7
141 19 19
142 29 29
143 95 95
144 16 16
145 36 36
146 8 8
147 999 999
148 164 164
149 125 125
150 16 16
151 11 11
152 7 7
153 15 15
154 8 8
155 66 66
156 17 17
157 92 92
158 25 25
159 18 18
160 169 169
161 43 43
162 12 12
163 39 39
164 8 8
165 5 5
166 3 3
167 8 8
168 11 11
169 274 274
170 46 46
171 27 27
172 12 12
173 30 30
174 13 13
175 19 19
176 4 4
177 15 15
178 4 4
179 3 3
180 6 6
181 8 8
182 5 5
183 18 18
184 7 7
185 9 9
186 12 12
187 9 9
188 5 5
189 113 113
190 30 30
191 169 169
192 33 33
193 17 17
194 4 4
195 5 5
196 7 7
197 5 5
198 7 7
199 12 12
200 5 5
201 10 10
202 7 7
203 40 40
204 744 744
205 309 309
206 98 98
207 35 35
208 8 8
209 3 3
210 24 24
211 7 7
212 5 5
213 3 3
214 5 5
215 21 21
216 29 29
217 547 547
218 130 130
219 63 63
220 13 13
221 33 33
222 9 9
223 7 7
224 1 1
225 1 1
226 2 2
227 9 9
228 7 7
229 37 37
230 23 23
231 65 65
232 21 21
233 32 32
234 14 14
235 6 6
236 2 2
237 2 2
238 1 1
239 2 2
240 6 6
241 13 13
242 10 10
243 111 111
244 41 41
245 36 36
246 16 16
247 21 21
248 6 6
249 3 3
250 1 1
253 2 2
254 4 4
255 7 7
256 11 11
257 15 15
258 6 6
259 17 17
260 7 7
261 6 6
262 9 9
263 5 5
264 2 2
265 7 7
266 2 2
267 2 2
268 9 9
269 12 12
270 9 9
271 105 105
272 28 28
273 17 17
274 12 12
275 8 8
276 10 10
277 4 4
278 3 3
279 2 2
280 1 1
281 1 1
283 1 1
284 2 2
286 3 3
287 2 2
288 3 3
289 4 4
290 2 2
291 16 16
292 6 6
293 4 4
294 1 1
295 1 1
297 1 1
298 1 1
299 1 1
300 20 20
301 6 6
302 4 4
303 3 3
304 7 7
305 24 24
306 10 10
307 9 9
308 3 3
309 1 1
313 1 1
315 1 1
316 1 1
317 10 10
318 10 10
319 120 120
320 43 43
321 21 21
322 6 6
323 2 2
329 1 1
330 2 2
331 25 25
332 18 18
333 13 13
334 5 5
335 2 2
336 1 1
337 2 2
338 1 1
342 1 1
343 4 4
344 3 3
345 10 10
346 6 6
347 4 4
348 3 3
349 1 1
357 1 1
358 4 4
359 5 5
360 24 24
361 584 584
362 211 211
363 103 103
364 28 28
365 9 9
366 2 2
367 1 1
373 5 5
374 4 4
375 1 1
376 3 3
377 4 4
378 3 3
379 2 2
389 2 2
390 5 5
391 3 3
392 2 2
393 1 1
409 4 4
410 2 2
427 1 1
434 1 1
435 2 2
436 2 2
448 1 1
449 2 2
450 5 5
451 14 14
452 9 9
453 4 4
454 2 2
463 2 2
464 3 3
465 1 1
466 1 1
476 1 1
478 1 1
479 5 5
480 22 22
481 13 13
482 7 7
483 2 2
//
system version 2.2.8-SNAPSHOT