ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003016
RECORD_TITLE: 2-TERT-BUTYLMERCAPTO-5-PICOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 2-TERT-BUTYLMERCAPTO-5-PICOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H15NS
CH$EXACT_MASS: 181.09252
CH$SMILES: Cc(c1)cnc(c1)SC(C)(C)C
CH$IUPAC: InChI=1S/C10H15NS/c1-8-5-6-9(11-7-8)12-10(2,3)4/h5-7H,1-4H3
CH$LINK: INCHIKEY OUDGLQWZPAJMRA-UHFFFAOYSA-N
AC$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$SPLASH: splash10-004i-4900000000-442abbd4fcbf2100c8b4
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  29 6 60
  39 9 90
  41 9 90
  53 0.6 6
  57 11 110
  65 6 60
  80 7 70
  81 0.3 3
  92 5 50
  97 5 50
  125 99.99 999
  126 0.11 1
  127 5 50
  181 8 80
  182 1 10
//
