ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011929
RECORD_TITLE: THIAMINE HYDROCHLORIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: THIAMINE HYDROCHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₈Cl₂N₄OS
CH$EXACT_MASS: 336.05784
CH$SMILES: N/A
CH$IUPAC: N/A
CH$LINK: CAS 67-03-8
CH$LINK: NIKKAJI J237.156A

AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-01si-9400000000-9ed62881779e1c1c841a
PK$NUM_PEAK: 70
PK$PEAK: m/z int. rel.int.
  14 1.23 12
  15 2.41 24
  26 6.35 64
  27 12.67 127
  28 16.55 166
  29 29.81 298
  30 4.53 45
  31 99.99 999
  32 3.12 31
  33 1.89 19
  35 3.64 36
  36 7 70
  37 2.35 24
  38 3.9 39
  39 11.17 112
  40 3.22 32
  41 5.87 59
  42 8.75 88
  43 7.4 74
  44 1.92 19
  45 22.79 228
  46 1.49 15
  47 2.1 21
  49 1.43 14
  50 5.76 58
  51 9.76 98
  52 8.83 88
  53 6.91 69
  54 3.57 36
  55 2.32 23
  57 1.92 19
  58 9.33 93
  59 10.66 107
  60 1.16 12
  61 1.24 12
  63 1.51 15
  68 1.15 12
  69 6.61 66
  70 2.43 24
  71 4.66 47
  72 1.47 15
  80 1.63 16
  81 1.86 19
  84 1.06 11
  85 10.01 100
  86 1.77 18
  97 1.01 10
  98 1.51 15
  111 1.06 11
  112 60.82 608
  113 26.77 268
  114 5.35 54
  115 2 20
  122 12.65 127
  123 1.81 18
  124 1.14 11
  125 2 20
  126 1.29 13
  138 3.07 31
  142 1.01 10
  143 36.11 361
  144 5.78 58
  145 2.52 25
  147 1.36 14
  148 1.24 12
  157 2.44 24
  159 1.19 12
  161 1.14 11
  233 2.55 26
  264 2.06 21
//