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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007857

2-BUTYLPYRIDINE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007857
RECORD_TITLE: 2-BUTYLPYRIDINE; 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$NAME: 2-BUTYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H13N
CH$EXACT_MASS: 135.10480
CH$SMILES: CCCCc(c1)nccc1
CH$IUPAC: InChI=1S/C9H13N/c1-2-3-6-9-7-4-5-8-10-9/h4-5,7-8H,2-3,6H2,1H3
CH$LINK: CAS 5058-19-5
CH$LINK: INCHIKEY ADSOSINJPNKUJK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00198597

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$SPLASH: splash10-0006-9200000000-fed4d7b9167955670156
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  29 3.72 37
  31 4.01 40
  38 2.26 23
  39 12.02 120
  40 1.28 13
  41 2.64 26
  42 3.81 38
  43 5.01 50
  51 13.02 130
  52 7.02 70
  53 1.43 14
  63 1.04 10
  64 2.71 27
  65 10.02 100
  66 12.02 120
  77 15.02 150
  78 13.29 133
  79 2.62 26
  91 2.03 20
  92 12.09 121
  93 99.99 999
  105 4.86 49
  106 33.04 330
  107 4.01 40
  118 3.01 30
  119 1.01 10
  120 13.02 130
  135 3.01 30
  136 1.01 10
//

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