ACCESSION: MSBNK-MSSJ-MSJ01105
RECORD_TITLE: Imazalil; GC-EI-Q; MS; Positive; M+*
DATE: 2017.07.13 (Created 2017.01.05)
AUTHORS: Shimadzu Corporation., Kyoto, Japan
LICENSE: CC BY
COPYRIGHT: Shimadzu Cooperation., Kyoto, Japan
PUBLICATION: Shimadzu Collection of Pesticide GCMS Data

CH$NAME: Imazalil
CH$COMPOUND_CLASS: Non-Natural Product; Pesticides
CH$FORMULA: C₁₄H₁₄Cl₂N₂O
CH$EXACT_MASS: 296.04832
CH$SMILES: Clc2ccc(C(OCC=C)Cn1ccnc1)c(Cl)c2
CH$IUPAC: InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2
CH$LINK: INCHIKEY PZBPKYOVPCNPJY-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:37175
CH$LINK: COMPTOX DTXSID8024151

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 12.9 min

MS$FOCUSED_ION: ION_TYPE [M]+*
MS$FOCUSED_ION: PRECURSOR_M/Z 296.0

PK$SPLASH: splash10-0006-9620000000-5eab79b2e44ba374700b
PK$NUM_PEAK: 98
PK$PEAK: m/z int. rel.int.
  40 8 8
  41 999 999
  42 23 23
  43 39 39
  44 23 23
  46 9 9
  47 7 7
  49 5 5
  50 7 7
  52 18 18
  53 13 13
  54 55 55
  55 19 19
  57 7 7
  59 7 7
  63 11 11
  67 13 13
  68 13 13
  69 19 19
  70 8 8
  74 20 20
  75 49 49
  76 21 21
  78 11 11
  79 5 5
  81 92 92
  82 19 19
  84 15 15
  86 9 9
  87 11 11
  89 30 30
  98 10 10
  101 29 29
  102 35 35
  103 12 12
  107 9 9
  108 7 7
  109 31 31
  111 21 21
  112 11 11
  113 15 15
  114 9 9
  115 31 31
  116 13 13
  121 5 5
  123 13 13
  125 14 14
  126 6 6
  127 5 5
  135 5 5
  136 23 23
  137 45 45
  138 14 14
  139 30 30
  140 13 13
  145 17 17
  146 11 11
  147 9 9
  149 19 19
  151 7 7
  152 7 7
  155 7 7
  159 50 50
  161 45 45
  162 7 7
  163 16 16
  164 7 7
  165 7 7
  168 8 8
  171 11 11
  172 48 48
  173 155 155
  174 70 70
  175 144 144
  176 25 25
  177 17 17
  179 8 8
  203 5 5
  204 5 5
  207 9 9
  212 5 5
  215 207 207
  216 31 31
  217 143 143
  218 16 16
  219 31 31
  240 15 15
  241 6 6
  242 20 20
  261 6 6
  267 5 5
  296 9 9
  300 5 5
  328 5 5
  333 7 7
  489 5 5
  492 5 5
  495 17 17
//