ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004859
RECORD_TITLE: 1,5-DIMETHOXYBICYCLO(3.2.2)NON-6-EN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1,5-DIMETHOXYBICYCLO(3.2.2)NON-6-EN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H16O3
CH$EXACT_MASS: 196.10994
CH$SMILES: COC(C1)(C2)C([H])=C([H])C(OC)(C2)C(=O)C1
CH$IUPAC: InChI=1S/C11H16O3/c1-13-10-4-3-9(12)11(14-2,7-5-10)8-6-10/h5,7H,3-4,6,8H2,1-2H3
CH$LINK: INCHIKEY HNFIVFXSUQTJJF-UHFFFAOYSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 14 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00di-0900000000-ee127b707e5024c42a81
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  89 3 30
  91 3 30
  93 3 30
  94 0.3 3
  96 3 30
  101 3.6 36
  104 5.2 52
  106 0.3 3
  107 4.2 42
  108 12.1 121
  109 8.5 85
  110 1.45 15
  111 4.8 48
  121 13 130
  124 99.99 999
  125 1.15 12
  126 4.2 42
  132 3.6 36
  135 3.6 36
  136 0.55 6
  137 6.4 64
  138 3.9 39
  139 5.5 55
  140 2.06 21
  141 5.2 52
  146 4.2 42
  148 3.9 39
  149 0.58 6
  150 3.3 33
  153 3.3 33
  173 4.2 42
  174 2.03 20
  175 4.5 45
  178 6.4 64
  180 3 30
  181 0.33 3
  196 12.7 127
  197 3.9 39
//
