MassBank Record: WA000048



 Clothianidin; 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: WA000048
RECORD_TITLE: Clothianidin; LC-ESI-QQ; MS2; CE:10 V; [M+H]+
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Clothianidin CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H8ClN5O2S CH$EXACT_MASS: 249.00872 CH$SMILES: CNC(NCc(c1)sc(Cl)n1)=N[N+1]([O-1])=O CH$IUPAC: InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11) CH$LINK: CAS 210880-92-5 CH$LINK: INCHIKEY PGOOBECODWQEAB-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID2034465
AC$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 10 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+ MS$FOCUSED_ION: PRECURSOR_M/Z 249.96 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-014i-0920000000-5d130b8b978272611c5f PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 110 8 8 112 20 20 129 8 8 131 486 486 147 8 8 167 94 94 169 999 999 170 16 16 173 8 8 175 8 8 204 43 43 206 47 47 220 12 12 250 321 321 251 12 12 //

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