MassBank Record: MSJ01098



 Iprodione; GC-EI-Q; MS; Positive; M+* 
Mass Spectrum
Chemical Structure
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ACCESSION: MSJ01098
RECORD_TITLE: Iprodione; GC-EI-Q; MS; Positive; M+*
DATE: 2017.07.13 (2017.01.05)
AUTHORS: , Shimadzu Corporation., Kyoto, Japan
LICENSE: CC BY
COPYRIGHT: Shimadzu Cooperation., Kyoto, Japan
PUBLICATION: Shimadzu Collection of Pesticide GCMS Data

CH$NAME: Iprodione CH$COMPOUND_CLASS: Non-Natural Product; Pesticides CH$FORMULA: C13H13Cl2N3O3 CH$EXACT_MASS: 329.03340 CH$SMILES: CC(C)NC(=O)N(C2)C(=O)N(C(=O)2)c(c1)cc(Cl)cc(Cl)1 CH$IUPAC: InChI=1S/C13H13Cl2N3O3/c1-7(2)16-12(20)17-6-11(19)18(13(17)21)10-4-8(14)3-9(15)5-10/h3-5,7H,6H2,1-2H3,(H,16,20) CH$LINK: INCHIKEY ONUFESLQCSAYKA-UHFFFAOYSA-N CH$LINK: PUBCHEM CID:37517
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$CHROMATOGRAPHY: RETENTION_TIME 16.9 min
MS$FOCUSED_ION: ION_TYPE [M]+* MS$FOCUSED_ION: PRECURSOR_M/Z 329.0
PK$SPLASH: splash10-06xx-9324000000-0dd814320ba1009acaad PK$NUM_PEAK: 146 PK$PEAK: m/z int. rel.int. 41 364 364 42 486 486 43 810 810 44 190 190 46 11 11 50 8 8 51 15 15 52 25 25 53 10 10 54 40 40 56 451 451 57 77 77 58 433 433 59 29 29 60 5 5 61 9 9 63 17 17 64 18 18 69 33 33 70 999 999 71 67 67 73 10 10 74 40 40 76 26 26 78 6 6 82 6 6 84 73 73 85 169 169 86 27 27 87 7 7 88 21 21 89 33 33 91 41 41 95 7 7 96 20 20 97 11 11 98 5 5 99 59 59 100 17 17 102 5 5 103 6 6 104 18 18 106 14 14 108 30 30 109 30 30 110 5 5 111 32 32 112 7 7 113 9 9 114 5 5 116 11 11 119 4 4 123 7 7 124 124 124 126 68 68 127 15 15 129 8 8 133 7 7 135 9 9 136 9 9 138 17 17 140 6 6 143 5 5 144 7 7 145 45 45 146 9 9 147 26 26 148 23 23 149 7 7 150 5 5 151 5 5 152 7 7 153 35 35 155 7 7 157 53 53 158 45 45 159 102 102 160 31 31 161 27 27 162 37 37 163 22 22 176 7 7 177 10 10 181 17 17 183 13 13 187 430 430 188 176 176 189 183 183 190 86 86 191 56 56 193 12 12 209 26 26 211 30 30 214 21 21 216 103 103 217 17 17 218 67 67 219 17 17 221 13 13 227 6 6 229 22 22 244 90 90 245 253 253 246 114 114 247 92 92 248 24 24 249 41 41 262 19 19 271 79 79 272 50 50 273 80 80 276 8 8 289 9 9 290 9 9 306 7 7 313 25 25 314 989 989 315 158 158 316 753 753 317 104 104 318 100 100 325 12 12 329 17 17 330 13 13 331 22 22 333 17 17 344 7 7 371 7 7 391 7 7 395 0 0 405 7 7 409 5 5 434 9 9 466 11 11 474 7 7 475 6 6 489 5 5 492 5 5 493 7 7 495 17 17 555 3 3 559 17 17 560 5 5 565 17 17 576 19 19 599 6 6 //