ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005020
RECORD_TITLE: 5-(2-CYCLOHEXYLETHYL)-2-METHYLPYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 5-(2-CYCLOHEXYLETHYL)-2-METHYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₁N
CH$EXACT_MASS: 203.16740
CH$SMILES: Cc(c2)ncc(c2)CCC(C1)CCCC1
CH$IUPAC: InChI=1S/C14H21N/c1-12-7-8-14(11-15-12)10-9-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3
CH$LINK: INCHIKEY RXNVXXITAMJILF-UHFFFAOYSA-N

AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4i-9810000000-2e4fe9f9893165a9c4fa
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  39 12.3 123
  40 2.1 21
  41 20 200
  42 0.35 4
  43 6.7 67
  44 1.2 12
  51 5 50
  52 0.31 3
  53 10 100
  54 4.6 46
  55 36.7 367
  56 0.38 4
  64 2.5 25
  65 7.8 78
  66 3.5 35
  67 1.43 14
  68 2.1 21
  69 6.1 61
  70 23.1 231
  78 0.68 7
  79 18.9 189
  80 2.5 25
  81 3.9 39
  83 0.5 5
  91 8.6 86
  92 4.8 48
  93 6 60
  94 0.74 7
  95 16.3 163
  96 2.1 21
  97 9.9 99
  104 0.25 3
  105 2.9 29
  106 47.5 475
  107 99.99 999
  108 2.01 20
  109 3.6 36
  115 4.2 42
  117 3.1 31
  119 0.88 9
  120 23 230
  121 8.2 82
  133 3 30
  147 0.29 3
  202 1.1 11
  203 27.2 272
  204 2.8 28
//