ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009808
RECORD_TITLE: 2-ETHENOXY-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 2-ETHENOXY-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H20O
CH$EXACT_MASS: 180.15142
CH$SMILES: C=COC(C1)C(C)(C2)C(C)(C)C(C2)1
CH$IUPAC: InChI=1S/C12H20O/c1-5-13-10-8-9-6-7-12(10,4)11(9,2)3/h5,9-10H,1,6-8H2,2-4H3
CH$LINK: INCHIKEY LQLLNKLOYCYFEB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30544285
AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-00m0-9300000000-3192d5bb93f4572e45b4
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  27 5.6 56
  29 5.8 58
  39 5.2 52
  41 1.7 17
  43 13.6 136
  53 6.1 61
  55 9.8 98
  57 1.06 11
  67 23.3 233
  68 3.1 31
  69 28.4 284
  71 0.98 10
  77 5 50
  79 7.2 72
  81 99.99 999
  82 0.94 9
  83 5.3 53
  91 4.4 44
  93 8.4 84
  95 3.84 38
  96 3.1 31
  107 2.3 23
  109 5.5 55
  121 0.39 4
  137 84.7 847
  138 9.8 98
//
