ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000775
RECORD_TITLE: 15-METHOXYBICYCLO(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$NAME: 15-METHOXYBICYCLO(8.3.2)PENTADECA-1(13),10(15),11-TRIEN-14-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H22O2
CH$EXACT_MASS: 246.16198
CH$SMILES: COC(=C21)C(=O)C(CCCCCCCC2)=CC=C1
CH$IUPAC: InChI=1S/C16H22O2/c1-18-16-14-10-7-5-3-2-4-6-9-13(15(16)17)11-8-12-14/h8,11-12H,2-7,9-10H2,1H3
CH$LINK: INCHIKEY QDSUTFXJGVJSFT-UHFFFAOYSA-N
AC$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: splash10-0002-2930000000-96c9bd20c4e890e8f484
PK$NUM_PEAK: 82
PK$PEAK: m/z int. rel.int.
  53 5 50
  55 13 130
  65 10 100
  67 0.9 9
  77 12 120
  78 7.5 75
  79 16 160
  81 0.7 7
  91 42 420
  92 8 80
  93 7.5 75
  95 0.55 6
  103 10.5 105
  104 10 100
  105 28 280
  106 0.6 6
  107 7 70
  108 7.5 75
  109 6 60
  115 1 10
  116 7 70
  117 14 140
  118 6 60
  119 1.4 14
  120 10 100
  121 20 200
  122 8 80
  123 0.55 6
  128 5 50
  129 10.5 105
  130 5.5 55
  131 1.75 18
  132 7 70
  133 18 180
  134 21 210
  135 2.2 22
  136 6.5 65
  137 8 80
  138 5 50
  143 0.65 7
  144 7.5 75
  145 15 150
  146 7 70
  147 1.9 19
  148 7.5 75
  149 11 110
  150 12.5 125
  151 0.7 7
  157 9 90
  158 6.5 65
  159 8 80
  160 0.45 5
  161 17 170
  162 6 60
  163 10 100
  164 0.95 10
  165 5 50
  171 7.5 75
  172 3 30
  173 0.8 8
  175 13 130
  176 6.5 65
  177 21 210
  178 0.45 5
  185 7 70
  186 4.5 45
  187 6.5 65
  188 2.85 29
  189 6 60
  190 3 30
  199 3.5 35
  203 1.6 16
  204 4.5 45
  215 6 60
  216 6 60
  217 0.45 5
  218 6 60
  229 3 30
  231 5 50
  246 99.99 999
  247 21.5 215
  248 4 40
//
