ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011145
RECORD_TITLE: METHYL ALPHA-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$NAME: METHYL ALPHA-D-GALACTOPYRANOSIDE
CH$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$SPLASH: splash10-0229-9000000000-4a1706d0c1048c7fb2f7
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  27 7.7 77
  30 2.2 22
  33 9 90
  39 3.4 34
  40 1.6 16
  41 7.1 71
  42 8.9 89
  43 19.7 197
  44 7 70
  45 20 200
  47 1.6 16
  53 1.6 16
  54 1.2 12
  55 8 80
  56 12.2 122
  57 51 510
  58 3.9 39
  59 11.7 117
  60 99.99 999
  61 43.3 433
  62 1.7 17
  69 8.9 89
  70 7.8 78
  71 37.3 373
  72 4.2 42
  73 73.8 738
  74 72 720
  75 12 120
  85 9.8 98
  86 3.8 38
  87 10.4 104
  88 1.4 14
  89 2.4 24
  91 9.6 96
  97 7.1 71
  98 8.4 84
  99 2.4 24
  101 2.3 23
  103 8.8 88
  104 3.9 39
  116 9.4 94
  117 1.8 18
  121 3.6 36
  127 1.6 16
  131 3.5 35
  133 6 60
  144 6.9 69
  145 6.2 62
  163 3.1 31
//