MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001167
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001167
RECORD_TITLE: PERMETHYLATED GALACTOSYL-(BETA1,3)-N-ACETYLGALACTOSAMINYL-(BETA1,4)-(N-ACETYLNEURAMINYL-(ALPHA2,8)-N-ACETYLNEURAMINYL(ALPHA2,3))-GALACTOSYL-(BETA1,4)-GLUCITOL; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: PERMETHYLATED GALACTOSYL-(BETA1,3)-N-ACETYLGALACTOSAMINYL-(BETA1,4)-(N-ACETYLNEURAMINYL-(ALPHA2,8)-N-ACETYLNEURAMINYL(ALPHA2,3))-GALACTOSYL-(BETA1,4)-GLUCITOL
CH$NAME: GD1B
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C73H131N3O37
CH$EXACT_MASS: 1641.84614
CH$SMILES: N/A
CH$IUPAC: N/A
AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 300 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS AMMONIA
PK$SPLASH: splash10-0ufu-0094100000-041a63896f82c2923e25
PK$NUM_PEAK: 84
PK$PEAK: m/z int. rel.int.
220 55.5 555
221 9 90
228 50.5 505
229 0.92 9
238 53 530
239 6 60
246 44 440
247 0.3 3
252 35.1 351
253 66.5 665
254 30 300
260 0.7 7
270 16.3 163
298 12 120
299 4 40
344 99.99 999
345 20.7 207
346 16.8 168
361 8.6 86
362 1.61 16
363 5.4 54
376 22.5 225
377 6.4 64
378 0.54 5
379 8.9 89
392 4.6 46
393 11.4 114
394 0.64 6
426 7.8 78
427 3 30
442 4 40
443 0.35 4
464 46.5 465
465 13.9 139
466 6.1 61
516 0.2 2
631 1.4 14
654 1.6 16
655 0.8 8
670 0.12 1
671 0.6 6
705 2.2 22
706 0.9 9
713 0.24 2
714 1 10
754 2.6 26
755 2 20
756 0.07 1
906 6.1 61
907 3.5 35
908 1.8 18
909 0.35 4
910 1.6 16
923 6.5 65
924 3 30
925 0.1 1
937 1.3 13
938 0.5 5
1014 0.1 1
1015 0.01 0
1016 0.1 1
1031 0.1 1
1032 0.2 2
1033 0.01 0
1047 0.1 1
1048 0.2 2
1049 0.1 1
1062 0.01 0
1063 0.2 2
1064 0.1 1
1079 0.1 1
1080 0.02 0
1081 0.1 1
1163 0.1 1
1178 0.2 2
1179 0.01 0
1266 0.4 4
1267 0.3 3
1283 0.2 2
1284 0.01 0
1641 0.1 1
1642 0.2 2
1643 0.1 1
1659 0.1 1
//