ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007851
RECORD_TITLE: 3-ETHYL-4-METHYLPYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 3-ETHYL-4-METHYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₁N
CH$EXACT_MASS: 121.08915
CH$SMILES: CCc(c1)c(C)ccn1
CH$IUPAC: InChI=1S/C8H11N/c1-3-8-6-9-5-4-7(8)2/h4-6H,3H2,1-2H3
CH$LINK: CAS 529-21-5
CH$LINK: INCHIKEY JDQNYWYMNFRKNQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1060182

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0ab9-5900000000-0612a9add2902aeaed46
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  29 1.61 16
  38 1.87 19
  39 22.83 228
  40 1.06 11
  41 5.62 56
  51 13.02 130
  52 2.35 24
  53 10.02 100
  63 5.82 58
  64 1.21 12
  65 7.12 71
  77 16.52 165
  78 1.78 18
  79 15.02 150
  80 1.01 10
  91 4.51 45
  92 2.26 23
  93 7.62 76
  105 2.04 20
  106 99.99 999
  107 9.72 97
  120 26.03 260
  121 67.57 676
  122 6.33 63
//