ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007860
RECORD_TITLE: 3-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$NAME: 3-BUTYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H13N
CH$EXACT_MASS: 135.10480
CH$SMILES: CCCCc(c1)cncc1
CH$IUPAC: InChI=1S/C9H13N/c1-2-3-5-9-6-4-7-10-8-9/h4,6-8H,2-3,5H2,1H3
CH$LINK: CAS 539-32-2
CH$LINK: INCHIKEY QSNMFWFDOFQASV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9060231
AC$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-caeb6174bd8805124c0a
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  27 1.22 12
  29 1.48 15
  31 2.01 20
  38 4.43 44
  39 15.02 150
  40 1.02 10
  41 1.98 20
  42 1.82 18
  43 10.02 100
  51 8.02 80
  52 4.01 40
  53 1.26 13
  64 2.18 22
  65 28.04 280
  66 8.02 80
  77 1.41 14
  78 5.01 50
  79 5.01 50
  91 4.84 48
  92 99.99 999
  93 91.09 911
  94 2.74 27
  105 1.09 11
  106 14.02 140
  107 3.01 30
  119 1.03 10
  120 2.01 20
  135 63.07 631
  136 7.02 70
//
