MassBank Record: WA000079



 Dimethirimol; LC-ESI-QQ; MS2; CE:30 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000079
RECORD_TITLE: Dimethirimol; LC-ESI-QQ; MS2; CE:30 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$NAME: Dimethirimol CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H19N3O CH$EXACT_MASS: 209.15281 CH$SMILES: CCCCc(c(C)1)c(O)nc(N(C)C)n1 CH$IUPAC: InChI=1S/C11H19N3O/c1-5-6-7-9-8(2)12-11(14(3)4)13-10(9)15/h5-7H2,1-4H3,(H,12,13,15) CH$LINK: CAS 5221-53-4
AC$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 30 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+ MS$FOCUSED_ION: PRECURSOR_M/Z 210.05 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-044m-9850000000-53ef1c8292fcf17f3f05 PK$NUM_PEAK: 33 PK$PEAK: m/z int. rel.int. 55 63 63 67 16 16 69 47 47 71 905 905 72 8 8 79 8 8 81 47 47 83 12 12 88 8 8 93 8 8 95 82 82 98 631 631 104 8 8 107 43 43 109 16 16 112 8 8 114 12 12 120 8 8 121 8 8 122 47 47 124 12 12 138 63 63 140 631 631 141 8 8 150 208 208 152 145 145 154 20 20 165 298 298 167 204 204 168 8 8 208 12 12 210 999 999 211 16 16 //