ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001822
RECORD_TITLE: DICYCLOHEXYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: DICYCLOHEXYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₃N
CH$EXACT_MASS: 181.18305
CH$SMILES: C(C2)CCC(C2)NC(C1)CCCC1
CH$IUPAC: InChI=1S/C12H23N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2
CH$LINK: INCHIKEY XBPCUCUWBYBCDP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6025018

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-052r-9800000000-b9af93fec53e937dfd80
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 2.46 25
  28 5.25 53
  29 4.12 41
  30 4.12 41
  39 3.32 33
  41 14.83 148
  42 1.99 20
  43 3.92 39
  44 9.44 94
  53 1.99 20
  54 2.39 24
  55 14.69 147
  56 44.22 442
  57 1.86 19
  67 2.46 25
  68 1.99 20
  69 1.2 12
  70 2.66 27
  79 1.06 11
  81 3.06 31
  82 7.98 80
  83 4.39 44
  96 1.4 14
  98 3.99 40
  100 5.32 53
  110 2.33 23
  125 1.06 11
  138 99.99 999
  139 10.31 103
  152 3.06 31
  181 11.64 116
  182 1.53 15
//