MassBank Record: WA000261



 Fomesafen; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000261
RECORD_TITLE: Fomesafen; LC-ESI-QQ; MS2; CE:10 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$NAME: Fomesafen CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H10ClF3N2O6S CH$EXACT_MASS: 437.99002 CH$SMILES: O=N(=O)c(c2)c(cc(c2)Oc(c1)c(Cl)cc(c1)C(F)(F)F)C(=O)NS(C)(=O)=O CH$IUPAC: InChI=1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22) CH$LINK: CAS 72178-02-0
AC$INSTRUMENT: QuattroPremier XE, Waters AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]- MS$FOCUSED_ION: PRECURSOR_M/Z 437 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-000i-0000900000-1a2184db18436038ed7b PK$NUM_PEAK: 1 PK$PEAK: m/z int. rel.int. 437 999 999 //