ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010827
RECORD_TITLE: METHYLANABASINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: METHYLANABASINE
CH$NAME: 3-(1-METHYL-2-PIPERIDYL)PYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₆N₂
CH$EXACT_MASS: 176.13135
CH$SMILES: CN(C2)C([H])(CCC2)c(c1)cncc1
CH$IUPAC: InChI=1S/C11H16N2/c1-13-8-3-2-6-11(13)10-5-4-7-12-9-10/h4-5,7,9,11H,2-3,6,8H2,1H3/t11-/m0/s1
CH$LINK: INCHIKEY WHAIHNKQZOMXJJ-NSHDSACASA-N

AC$INSTRUMENT: JEOL JMS-AX-505-H
AC$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$SPLASH: splash10-0002-9500000000-04ae7dcf9b67bfd07386
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  51 1.06 11
  52 1.97 20
  58 1.21 12
  65 1.93 19
  70 3.34 33
  73 1 10
  77 1.91 19
  78 4.03 40
  79 1.99 20
  81 1.32 13
  83 1.12 11
  90 2.03 20
  91 1.16 12
  92 5.4 54
  93 1.68 17
  95 1.24 12
  97 1.03 10
  98 99.99 999
  99 3.83 38
  104 5.08 51
  105 3.66 37
  106 2.64 26
  118 4.37 44
  119 12.06 121
  120 5.61 56
  132 2.97 30
  133 5.74 57
  134 1.69 17
  147 5.7 57
  161 2.94 29
  175 8.42 84
  176 21.03 210
  177 1.92 19
  191 1.22 12
  354 2.06 21
//