MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003014

TERT-BUTYL 2-PICOLYL SULFIDE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003014
RECORD_TITLE: TERT-BUTYL 2-PICOLYL SULFIDE; 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

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CH$NAME: TERT-BUTYL 2-PICOLYL SULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₅NS
CH$EXACT_MASS: 181.09252
CH$SMILES: CC(C)(C)SCc(c1)nccc1
CH$IUPAC: InChI=1S/C10H15NS/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3
CH$LINK: INCHIKEY MUYGHECDSGHWQJ-UHFFFAOYSA-N

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-004i-5900000000-6c6dc8dd9c35d3d2faae
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  29 11 110
  39 7 70
  41 15 150
  57 3 30
  65 10 100
  78 10 100
  79 13 130
  80 0.07 1
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  124 37 370
  125 99.99 999
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  166 2 20
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  182 0.7 7
//