MassBank Record: WA000144



 Furathiocarb; LC-ESI-QQ; MS2; CE:40 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000144
RECORD_TITLE: Furathiocarb; LC-ESI-QQ; MS2; CE:40 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$NAME: Furathiocarb CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H26N2O5S CH$EXACT_MASS: 382.15624 CH$SMILES: CCCCOC(=O)N(C)SN(C)C(=O)Oc(c2)c(O1)c(cc2)CC(C)(C)1 CH$IUPAC: InChI=1S/C18H26N2O5S/c1-6-7-11-23-16(21)19(4)26-20(5)17(22)24-14-10-8-9-13-12-18(2,3)25-15(13)14/h8-10H,6-7,11-12H2,1-5H3 CH$LINK: CAS 65907-30-4
AC$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 40 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+ MS$FOCUSED_ION: PRECURSOR_M/Z 383.24 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-03fs-1900000000-61ee7c7e263b551bd71d PK$NUM_PEAK: 60 PK$PEAK: m/z int. rel.int. 52 12 12 55 98 98 57 208 208 58 59 59 62 114 114 64 20 20 67 20 20 69 8 8 70 12 12 72 12 12 76 67 67 77 8 8 79 67 67 81 20 20 84 137 137 86 51 51 90 188 188 91 20 20 93 47 47 94 47 47 96 286 286 98 12 12 102 47 47 105 298 298 107 129 129 108 212 212 110 71 71 112 8 8 114 63 63 116 212 212 117 82 82 119 12 12 120 43 43 122 333 333 125 909 909 126 31 31 131 145 145 133 219 219 134 149 149 136 39 39 139 102 102 140 8 8 142 16 16 143 309 309 145 51 51 146 239 239 149 697 697 151 35 35 153 165 165 154 8 8 160 43 43 162 999 999 164 725 725 167 799 799 168 27 27 177 255 255 178 8 8 180 20 20 195 337 337 196 12 12 //