MassBank Record: WA000244



 Flumetsulam; LC-ESI-QQ; MS2; CE:60 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000244
RECORD_TITLE: Flumetsulam; LC-ESI-QQ; MS2; CE:60 V; [M+H]+
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: Copyright 2007-2011 Nihon Waters K.K.

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$LINK: CAS 98967-40-9
AC$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 60 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: splash10-0a6r-0900000000-814371bbce55788722f0 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 101 501 501 103 20 20 105 16 16 107 114 114 109 944 944 110 47 47 115 12 12 119 12 12 123 16 16 126 16 16 129 999 999 130 39 39 134 16 16 144 12 12 147 8 8 //