MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001165
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001165
RECORD_TITLE: PERMETHYLATED GALACTOSYL-(BETA1,3)-N-ACETYLGALACTOSAMINYL-(BETA1,4)-(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$NAME: PERMETHYLATED GALACTOSYL-(BETA1,3)-N-ACETYLGALACTOSAMINYL-(BETA1,4)-(N-ACETYLNEURAMINYL(ALPHA2,3))-GALACTOSYL(BETA1,4)-GLUCITOL
CH$NAME: GM1
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C57H104N2O29
CH$EXACT_MASS: 1280.67248
CH$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: splash10-0w2l-0095100000-327ab586a7bbb7d1a39e
PK$NUM_PEAK: 83
PK$PEAK: m/z int. rel.int.
214 58.6 586
215 12.7 127
220 34.4 344
221 17.2 172
228 60.5 605
229 14.6 146
236 75.8 758
237 12.7 127
238 42 420
239 7.6 76
246 62.4 624
247 15.3 153
252 72 720
253 57.3 573
254 31.8 318
298 16.6 166
299 3 30
334 61.5 615
335 5.9 59
344 99.99 999
345 21.7 217
346 7.2 72
351 24.4 244
352 7 70
360 14.6 146
361 7.6 76
362 17.2 172
363 8.3 83
376 26.8 268
377 8.9 89
378 2.5 25
393 15.3 153
394 8.2 82
426 13.4 134
427 3.8 38
464 65 650
465 17.8 178
480 15.9 159
481 4.5 45
533 1 10
535 1 10
550 1 10
566 1.6 16
567 0.8 8
568 1.4 14
569 0.7 7
582 1.3 13
652 1.2 12
653 0.7 7
654 2.4 24
655 1.3 13
656 0.7 7
670 1.3 13
671 0.08 1
687 0.18 2
803 0.13 1
817 0.48 5
818 0.19 2
835 0.12 1
845 1 10
863 0.13 1
874 0.14 1
906 0.31 3
907 0.19 2
923 0.37 4
924 0.16 2
926 0.08 1
1015 0.05 1
1029 0.1 1
1045 0.17 2
1046 0.1 1
1061 0.09 1
1062 0.07 1
1077 0.03 0
1094 0.03 0
1250 0.16 2
1251 0.1 1
1264 0.08 1
1281 0.41 4
1282 0.37 4
1283 0.1 1
1298 0.37 4
1299 1.2 12
//