ACCESSION: MSBNK-Waters-WA000093
RECORD_TITLE: Thiamethoxam; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Thiamethoxam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀ClN₅O₃S
CH$EXACT_MASS: 291.01929
CH$SMILES: O=N(=O)N=C(N(C)2)N(COC2)Cc(c1)sc(Cl)n1
CH$IUPAC: InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8-
CH$LINK: CAS 153719-23-4
CH$LINK: INCHIKEY NWWZPOKUUAIXIW-FLIBITNWSA-N

AC$INSTRUMENT: QuattroPremier XE, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40 V

MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 292.06
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-053r-0900000000-3561fe43a82b46ff6679
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  106 12 12
  108 509 509
  109 31 31
  112 63 63
  113 12 12
  118 27 27
  120 8 8
  122 149 149
  123 31 31
  124 145 145
  126 8 8
  131 999 999
  133 20 20
  138 55 55
  139 12 12
  146 16 16
  150 20 20
  152 298 298
  153 12 12
  165 16 16
  175 8 8
  181 43 43
//