ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003978
RECORD_TITLE: 2-HEXYLPYRIDINE; 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$NAME: 2-HEXYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₇N
CH$EXACT_MASS: 163.13610
CH$SMILES: CCCCCCc(c1)nccc1
CH$IUPAC: InChI=1S/C11H17N/c1-2-3-4-5-8-11-9-6-7-10-12-11/h6-7,9-10H,2-5,8H2,1H3
CH$LINK: INCHIKEY NZLJDTKLZIMONR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10150207

AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-0006-9200000000-bf54e6006e95c9a5b19e
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
  26 3 30
  27 16 160
  28 8.2 82
  29 1.1 11
  38 3.3 33
  39 13.5 135
  40 2.1 21
  41 0.93 9
  42 2.5 25
  43 2.4 24
  50 2.5 25
  51 0.54 5
  52 4.3 43
  53 2.7 27
  55 2.7 27
  57 0.22 2
  63 2 20
  64 2.5 25
  65 6.3 63
  66 0.43 4
  67 2 20
  77 2.5 25
  78 5.6 56
  79 0.32 3
  80 2.5 25
  91 2.9 29
  92 5.5 55
  93 99.99 999
  94 6.4 64
  106 7.5 75
  107 2.2 22
  117 0.21 2
  118 6.9 69
  119 2.3 23
  120 10.5 105
  121 0.24 2
  132 2.1 21
  134 7.8 78
  135 2.5 25
  148 0.56 6
  149 2.6 26
  163 2.1 21
  164 2.6 26
//