ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003929
RECORD_TITLE: 4-METHYLPYRIDINE; 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$NAME: 4-METHYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₇N
CH$EXACT_MASS: 93.05785
CH$SMILES: Cc(c1)ccnc1
CH$IUPAC: InChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5H,1H3
CH$LINK: INCHIKEY FKNQCJSGGFJEIZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4021892

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9000000000-58d023e3253e07273ffe
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  25 2.1 21
  26 10.7 107
  27 10 100
  28 0.75 8
  31 3 30
  37 7.3 73
  38 16 160
  39 4.07 41
  40 16.4 164
  41 6.2 62
  42 2 20
  49 0.28 3
  50 10.7 107
  51 15.9 159
  52 8 80
  53 0.69 7
  54 7.8 78
  61 3.3 33
  62 5.7 57
  63 0.9 9
  64 5.5 55
  65 24.2 242
  66 43 430
  78 0.9 9
  91 3.5 35
  92 24.1 241
  93 99.99 999
  94 0.85 9
  107 3.2 32
//