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MassBank Record: WA000240

Flumetsulam; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: WA000240
RECORD_TITLE: Flumetsulam; LC-ESI-QQ; MS2; CE:20 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$NAME: Flumetsulam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H9F2N5O2S
CH$EXACT_MASS: 325.04450
CH$SMILES: CC(C=3)=Nc(n1)n(C3)nc1S(=O)(=O)Nc(c(F)2)c(F)ccc2
CH$IUPAC: InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3
CH$LINK: CAS 98967-40-9
CH$LINK: INCHIKEY RXCPQSJAVKGONC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4032615

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 20 V

MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 326
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-004i-0901000000-ba4f54938fb4ef964ec3
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  93 12 12
  127 16 16
  129 999 999
  130 16 16
  134 31 31
  144 71 71
  153 8 8
  182 31 31
  192 71 71
  197 39 39
  242 20 20
  262 78 78
  326 149 149
  327 8 8
//

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