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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009033

3-METHYLPYRIDINE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009033
RECORD_TITLE: 3-METHYLPYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 3-METHYLPYRIDINE
CH$NAME: 3-PICOLINE
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$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-00kf-9000000000-759c5b98b6c617c91a18
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  26 2.85 29
  27 3.61 36
  28 4.73 47
  37 4.21 42
  38 10.75 108
  39 35.1 351
  40 12.74 127
  41 2.96 30
  49 1.03 10
  50 4.79 48
  51 6.3 63
  52 3.41 34
  53 2.46 25
  54 1.92 19
  61 2.65 27
  62 4.74 47
  63 10.81 108
  64 4.35 44
  65 24.82 248
  66 38.56 386
  67 11.85 119
  78 3.49 35
  91 1.03 10
  92 28.5 285
  93 99.99 999
  94 7.17 72
//

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