ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000781
RECORD_TITLE: 15-METHYLAMINOBICYCLO(8.3.2)PENTADECA-1(13),10(15),11-TRIEN-14-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ITO S, DEPT. OF CHEM., TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 15-METHYLAMINOBICYCLO(8.3.2)PENTADECA-1(13),10(15),11-TRIEN-14-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H23NO
CH$EXACT_MASS: 245.17796
CH$SMILES: CNC(=C21)C(=O)C(CCCCCCCC2)=CC=C1
CH$IUPAC: InChI=1S/C16H23NO/c1-17-15-13-9-6-4-2-3-5-7-10-14(16(15)18)12-8-11-13/h8,11-12H,2-7,9-10H2,1H3,(H,17,18)
CH$LINK: INCHIKEY WHGBDABPPUJDAD-UHFFFAOYSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000t-1930000000-a985d67b27459c6db298
PK$NUM_PEAK: 101
PK$PEAK: m/z int. rel.int.
  53 5.5 55
  55 10 100
  56 5 50
  57 0.3 3
  65 6 60
  67 8.5 85
  68 5 50
  69 0.5 5
  70 5 50
  77 15.5 155
  78 8 80
  79 1.3 13
  80 6 60
  81 5.5 55
  91 29 290
  92 0.9 9
  93 9 90
  94 11 110
  95 6.5 65
  96 0.4 4
  97 4 40
  103 9 90
  104 10 100
  105 1.85 19
  106 9 90
  107 13 130
  108 13 130
  109 0.9 9
  110 4 40
  111 4 40
  115 11 110
  116 0.55 6
  117 20 200
  118 17 170
  119 10 100
  120 2.05 21
  121 16.5 165
  122 25 250
  123 7.5 75
  124 0.45 5
  128 3 30
  129 7 70
  130 24 240
  131 2.4 24
  132 34 340
  133 24 240
  134 24 240
  135 1.3 13
  136 10 100
  137 9 90
  141 5 50
  143 1.45 15
  144 28.5 285
  145 25 250
  146 31 310
  147 1.55 16
  148 20 200
  149 14 140
  150 9 90
  157 1.8 18
  158 20 200
  159 14.5 145
  160 26 260
  161 1.5 15
  162 19.5 195
  163 20 200
  171 12 120
  172 1.05 11
  173 11 110
  174 32.5 325
  175 12 120
  176 2.85 29
  177 9 90
  184 7 70
  185 13 130
  186 6.2 62
  187 15 150
  188 23 230
  189 11 110
  190 0.7 7
  197 11 110
  198 4.5 45
  199 8.5 85
  200 0.4 4
  202 15.5 155
  203 5 50
  204 5 50
  212 0.6 6
  214 9 90
  215 5 50
  216 13 130
  217 0.85 9
  218 4 40
  227 6.5 65
  228 28 280
  229 0.5 5
  230 39.5 395
  231 6.5 65
  244 9 90
  245 99.99 999
  246 20.5 205
//
