ACCESSION: MSBNK-Waters-WA000208
RECORD_TITLE: Dichlorprop; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Dichlorprop
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₈Cl₂O₃
CH$EXACT_MASS: 233.98505
CH$SMILES: OC(=O)C(C)Oc(c1)c(Cl)cc(Cl)c1
CH$IUPAC: InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)
CH$LINK: CAS 120-36-5
CH$LINK: INCHIKEY MZHCENGPTKEIGP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0020440

AC$INSTRUMENT: QuattroPremier XE, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V

MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$FOCUSED_ION: PRECURSOR_M/Z 232.8
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-03di-0920000000-963eb9604518ae0fd2c3
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  126 8 8
  135 8 8
  159 16 16
  161 999 999
  186 8 8
  189 24 24
  233 262 262
  234 8 8
//