ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009523
RECORD_TITLE: 3-PICOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: 3-PICOLINE
CH$NAME: 3-METHYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₇N
CH$EXACT_MASS: 93.05785
CH$SMILES: Cc(c1)cncc1
CH$IUPAC: InChI=1S/C6H7N/c1-6-3-2-4-7-5-6/h2-5H,1H3
CH$LINK: CAS 108-99-6
CH$LINK: INCHIKEY ITQTTZVARXURQS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021897

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 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9000000000-f5d09461ea2a38433f8f
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  25 1.3 13
  26 1.73 17
  27 2.44 24
  37 2.05 21
  38 5.21 52
  39 20.32 203
  40 6.47 65
  41 1.84 18
  50 2.54 25
  51 3.98 40
  52 1.82 18
  53 1.6 16
  54 1.79 18
  61 1.86 19
  62 4.35 44
  63 9.1 91
  64 3.95 40
  65 23.81 238
  66 35.1 351
  67 9.52 95
  78 2.59 26
  91 1.35 14
  92 28.45 285
  93 99.99 999
  94 14.6 146
//