ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010049
RECORD_TITLE: 1-METHYL-4-(11-METHOXYCARBONYL-5,9-DIMETHYL-1-OXOUNDECA-4,8-DIENYL)-PIPERADINE; 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$NAME: 1-METHYL-4-(11-METHOXYCARBONYL-5,9-DIMETHYL-1-OXOUNDECA-4,8-DIENYL)-PIPERADINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H34N2O3
CH$EXACT_MASS: 350.25694
CH$SMILES: COC(=O)CCC(C)=CCCC(C)=CCCC(=O)N(C1)CCN(C)C1
CH$IUPAC: InChI=1S/C20H34N2O3/c1-17(7-5-8-18(2)11-12-20(24)25-4)9-6-10-19(23)22-15-13-21(3)14-16-22/h8-9H,5-7,10-16H2,1-4H3/b17-9-,18-8-
CH$LINK: INCHIKEY NCVBXHMUXQRVJI-DWFXYBKLSA-N
AC$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: splash10-0pba-9341000000-85790decc5e28dab5dbf
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  43 18.77 188
  44 19.37 194
  56 27.11 271
  57 29 290
  58 42.87 429
  70 49.43 494
  81 33.93 339
  83 18.02 180
  98 40.67 407
  99 53.55 536
  101 64.84 648
  127 23.42 234
  166 32.31 323
  209 99.99 999
  210 25.43 254
  277 36.71 367
  319 11.25 113
  350 38.52 385
//
