MassBank Record: WA000192



 Cloprop; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000192
RECORD_TITLE: Cloprop; 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: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Cloprop CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H9ClO3 CH$EXACT_MASS: 200.02402 CH$SMILES: OC(=O)C(C)Oc(c1)cc(Cl)cc1 CH$IUPAC: InChI=1S/C9H9ClO3/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H,11,12) CH$LINK: CAS 101-10-0
AC$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 198.8 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-002b-0900000000-1a67bfbe1235d0c3ee2e PK$NUM_PEAK: 4 PK$PEAK: m/z int. rel.int. 71 27 27 127 642 642 155 12 12 199 999 999 //