ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000468
RECORD_TITLE: 2,4,5-TRIMETHYLTHIAZOLE; 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$NAME: 2,4,5-TRIMETHYLTHIAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H9NS
CH$EXACT_MASS: 127.04557
CH$SMILES: Cc(n1)c(C)sc(C)1
CH$IUPAC: InChI=1S/C6H9NS/c1-4-5(2)8-6(3)7-4/h1-3H3
CH$LINK: INCHIKEY BAMPVSWRQZNDQC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5065564
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004r-9300000000-4d825c6d47604fba88c1
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  26 2.8 28
  27 10.9 109
  29 1.4 14
  37 0.1 1
  38 2.3 23
  39 9.7 97
  40 3.3 33
  41 0.85 9
  42 11.5 115
  43 9.2 92
  45 20.6 206
  46 0.27 3
  47 1.9 19
  50 3.6 36
  51 5.7 57
  52 0.33 3
  53 10.2 102
  54 1.4 14
  57 2.7 27
  58 1.1 11
  59 24.4 244
  60 2.1 21
  61 1.3 13
  66 0.11 1
  68 3.5 35
  69 5.9 59
  70 2.7 27
  71 9.51 95
  72 5.2 52
  73 5.1 51
  78 1.1 11
  84 0.13 1
  85 32.1 321
  86 71 710
  87 5.7 57
  88 0.36 4
  112 3.7 37
  126 9.3 93
  127 99.99 999
  128 0.85 9
  129 5.3 53
//
