MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011147
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011147
RECORD_TITLE: METHYL BETA-D-GALACTOPYRANOSIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SAWADA M, THE INST. OF SCIENTIFIC AND INDUSTRIALRESEARCH OSAKA UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL BETA-D-GALACTOPYRANOSIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H14O6
CH$EXACT_MASS: 194.07904
CH$SMILES: OCC([H])(O1)C([H])(O)C([H])(O)C([H])(O)C([H])(OC)1
CH$IUPAC: InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4?,5-,6-,7?/m1/s1
CH$LINK: INCHIKEY
HOVAGTYPODGVJG-HJPAEZFKSA-N
AC$INSTRUMENT: JEOL JMS-DX-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0229-9000000000-505fb08ac939d34e021e
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
27 6.2 62
30 2 20
33 8 80
39 2.9 29
40 1.7 17
41 6.8 68
42 8.1 81
43 16.6 166
44 7.6 76
45 15.1 151
47 1.5 15
55 7.7 77
56 13.4 134
57 51.6 516
58 3.5 35
59 8 80
60 99.99 999
61 36.2 362
62 1.4 14
69 7.3 73
70 6.9 69
71 33.4 334
72 3.3 33
73 59.1 591
74 48.5 485
75 10.8 108
85 5.3 53
86 2.9 29
87 7.4 74
88 1.2 12
89 1.9 19
91 1.9 19
97 5.7 57
98 6.8 68
99 1.8 18
101 1.4 14
103 7.5 75
104 3.1 31
116 6.9 69
117 1.5 15
121 3 30
131 3.9 39
133 3.5 35
144 4.9 49
145 4 40
146 1.4 14
163 1.7 17
//