MassBank Record: MSJ01073



 Anilofos; GC-EI-Q; MS; Positive; M+* 
Mass Spectrum
Chemical Structure
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ACCESSION: MSJ01073
RECORD_TITLE: Anilofos; GC-EI-Q; MS; Positive; M+*
DATE: 2017.07.13 (2016.12.28)
AUTHORS: , Shimadzu Corporation., Kyoto, Japan
LICENSE: CC BY
COPYRIGHT: Shimadzu Cooperation., Kyoto, Japan
PUBLICATION: Shimadzu Collection of Pesticide GCMS Data

CH$NAME: Anilofos CH$COMPOUND_CLASS: Non-Natural Product; Pesticides CH$FORMULA: C13H19ClNO3PS2 CH$EXACT_MASS: 367.02325 CH$SMILES: CC(C)N(C(=O)CSP(=S)(OC)OC)c(c1)ccc(Cl)c1 CH$IUPAC: InChI=1S/C13H19ClNO3PS2/c1-10(2)15(12-7-5-11(14)6-8-12)13(16)9-21-19(20,17-3)18-4/h5-8,10H,9H2,1-4H3 CH$LINK: INCHIKEY NXQDBZGWYSEGFL-UHFFFAOYSA-N CH$LINK: PUBCHEM CID:91687
AC$INSTRUMENT: GCMS-QP2010 Plus, Shimadzu AC$INSTRUMENT_TYPE: GC-EI-Q AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION EI AC$CHROMATOGRAPHY: COLUMN_NAME Ptx-5MS(RESTEK), 0.32 mm I.D. x 30 m, df=0.25 microm AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 80 C (1 min)-20 C/min - 180 C - 5 C/min - 330C (10 min) AC$CHROMATOGRAPHY: INJECTION_TEMPERATURE 260 C AC$CHROMATOGRAPHY: RETENTION_TIME 17.8 min
MS$FOCUSED_ION: ION_TYPE [M]+* MS$FOCUSED_ION: PRECURSOR_M/Z 367.02
PK$SPLASH: splash10-0fbc-4910000000-d54440556fea23ae7573 PK$NUM_PEAK: 171 PK$PEAK: m/z int. rel.int. 40 8 8 41 231 231 42 84 84 43 780 780 44 296 296 45 27 27 46 28 28 47 156 156 48 16 16 49 17 17 50 35 35 51 27 27 52 20 20 54 15 15 55 18 18 56 18 18 57 26 26 58 13 13 59 26 26 61 30 30 62 42 42 63 186 186 64 23 23 65 42 42 66 14 14 67 9 9 68 9 9 69 13 13 70 14 14 72 19 19 73 5 5 74 6 6 75 94 94 76 42 42 77 75 75 78 18 18 79 205 205 80 103 103 81 31 31 83 20 20 84 94 94 85 24 24 86 6 6 89 42 42 90 31 31 91 79 79 92 44 44 93 316 316 95 48 48 96 71 71 98 10 10 99 38 38 100 11 11 101 32 32 102 12 12 103 11 11 104 25 25 108 10 10 109 45 45 110 65 65 111 159 159 112 28 28 113 75 75 114 12 12 115 21 21 116 26 26 117 33 33 118 141 141 119 109 109 120 20 20 122 5 5 123 5 5 124 8 8 125 663 663 126 144 144 127 386 386 128 65 65 129 96 96 130 18 18 131 6 6 132 43 43 133 67 67 135 14 14 136 42 42 137 5 5 138 170 170 139 37 37 140 124 124 141 14 14 142 53 53 143 21 21 148 5 5 149 20 20 151 43 43 152 187 187 153 144 144 154 999 999 155 188 188 156 324 324 157 182 182 158 84 84 159 44 44 160 7 7 161 14 14 162 5 5 163 7 7 164 21 21 166 53 53 167 112 112 168 130 130 169 234 234 170 58 58 171 217 217 172 19 19 173 18 18 174 20 20 177 5 5 178 18 18 181 5 5 182 47 47 183 161 161 184 318 318 185 49 49 186 69 69 187 16 16 192 45 45 193 19 19 194 50 50 195 5 5 196 65 65 197 6 6 198 17 17 199 89 89 200 7 7 201 6 6 207 5 5 208 35 35 209 39 39 210 61 61 211 119 119 212 22 22 213 34 34 214 11 11 221 9 9 225 74 74 226 533 533 227 79 79 228 187 187 229 9 9 230 9 9 242 5 5 266 8 8 267 6 6 281 9 9 287 5 5 290 5 5 292 10 10 293 5 5 294 11 11 302 5 5 312 6 6 325 7 7 327 7 7 334 52 52 336 34 34 359 5 5 365 5 5 378 5 5 402 5 5 464 7 7 548 5 5 //