ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004724
RECORD_TITLE: 4-ISOPROPYL-6-METHYLENE-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1(2H)-NAPHTHALENONE; 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$NAME: 4-ISOPROPYL-6-METHYLENE-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1(2H)-NAPHTHALENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H22O
CH$EXACT_MASS: 206.16707
CH$SMILES: CC(C)C(C1)C(C2)C(CCC(=C)2)C(=O)C1
CH$IUPAC: InChI=1S/C14H22O/c1-9(2)11-6-7-14(15)12-5-4-10(3)8-13(11)12/h9,11-13H,3-8H2,1-2H3
CH$LINK: CAS 82096-16-0
CH$LINK: INCHIKEY JSJLUTZQCLOLOV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10702381
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-053r-9410000000-dbe58e3a031386772c52
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  43 18.09 181
  53 11.4 114
  55 30.17 302
  67 19.64 196
  69 23.52 235
  77 16.68 167
  79 32.45 325
  80 24.44 244
  81 60.21 602
  82 10.1 101
  83 99.99 999
  91 20.78 208
  92 11.97 120
  93 31.76 318
  94 10 100
  95 17.86 179
  105 11.4 114
  107 13.9 139
  109 10.78 108
  119 9.24 92
  121 31.87 319
  123 11.1 111
  135 10.88 109
  136 12.35 124
  139 50.57 506
  145 34.75 348
  163 33.75 338
  188 9.76 98
  206 57.26 573
  207 9.07 91
//
