ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004161
RECORD_TITLE: N-HEXYL-6-HYDROXYHEXANAMIDE; EI-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$NAME: N-HEXYL-6-HYDROXYHEXANAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₅NO₂
CH$EXACT_MASS: 215.18853
CH$SMILES: CCCCCCNC(=O)CCCCCO
CH$IUPAC: InChI=1S/C12H25NO2/c1-2-3-4-7-10-13-12(15)9-6-5-8-11-14/h14H,2-11H2,1H3,(H,13,15)
CH$LINK: INCHIKEY DNHFCFYTJSCXOI-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI RMU-6E
AC$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$SPLASH: splash10-0536-9300000000-8b30fb08c7440ad9593a
PK$NUM_PEAK: 151
PK$PEAK: m/z int. rel.int.
  25 0.2 2
  26 1.8 18
  27 26.4 264
  28 2.1 21
  29 42 420
  30 99.99 999
  31 44.8 448
  32 0.17 2
  33 0.1 1
  38 0.5 5
  39 17 170
  40 0.34 3
  41 95.6 956
  42 24.8 248
  43 98 980
  44 6 60
  45 10 100
  46 1.1 11
  47 0.4 4
  50 0.04 0
  51 0.8 8
  52 0.6 6
  53 6.6 66
  54 0.64 6
  55 56.6 566
  56 20 200
  57 26.2 262
  58 2.5 25
  59 8 80
  60 13 130
  61 0.4 4
  62 0.03 0
  63 0.2 2
  64 0.2 2
  65 1.1 11
  66 0.08 1
  67 11.2 112
  68 4.8 48
  69 79.6 796
  70 1.36 14
  71 7.6 76
  72 26.4 264
  73 75.4 754
  74 0.39 4
  75 0.5 5
  76 0.3 3
  77 0.4 4
  78 0.03 0
  79 8.8 88
  80 1.3 13
  81 1.9 19
  82 0.23 2
  83 4.6 46
  84 12.8 128
  85 20.2 202
  86 5.32 53
  87 38.4 384
  88 2.4 24
  89 0.2 2
  94 0.04 0
  95 1.2 12
  96 1.9 19
  97 44 440
  98 1.2 12
  99 4.2 42
  100 37 370
  101 35 350
  102 1.26 13
  103 0.8 8
  104 0.2 2
  105 0.2 2
  107 0.02 0
  108 0.3 3
  109 1 10
  110 0.5 5
  111 0.07 1
  112 4.2 42
  113 3.1 31
  114 38 380
  115 5.4 54
  116 4.6 46
  117 0.6 6
  118 0.2 2
  124 0.02 0
  125 0.6 6
  126 9 90
  127 11 110
  128 3.52 35
  129 3.7 37
  130 1 10
  131 0.2 2
  132 0.06 1
  133 0.2 2
  134 0.2 2
  138 0.4 4
  139 0.04 0
  140 5.4 54
  141 3.7 37
  142 1.4 14
  143 9.6 96
  144 11.4 114
  145 34.4 344
  146 2.3 23
  147 0.02 0
  148 0.1 1
  149 1.7 17
  150 0.2 2
  151 0.01 0
  152 0.3 3
  153 0.2 2
  154 15.6 156
  155 0.36 4
  156 48 480
  157 4.7 47
  158 10.4 104
  159 0.19 2
  160 0.4 4
  161 0.1 1
  166 0.1 1
  167 0.03 0
  168 4.2 42
  169 1.1 11
  170 11.4 114
  171 0.2 2
  172 32 320
  173 5 50
  174 0.5 5
  180 0.03 0
  181 0.2 2
  182 1.4 14
  183 0.4 4
  184 0.6 6
  185 6 60
  186 16.6 166
  187 2.1 21
  188 0.01 0
  194 0.1 1
  195 0.2 2
  196 1 10
  197 0.5 5
  198 6 60
  199 1 10
  200 2 20
  201 0.04 0
  212 0.2 2
  213 0.4 4
  214 2.6 26
  215 3.2 32
  216 41.4 414
  217 0.5 5
  218 0.1 1
//