MassBank Record: WA002255



 Hydroxyhaloperidol; LC-ESI-Q; MS; POS; 60 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002255
RECORD_TITLE: Hydroxyhaloperidol; LC-ESI-Q; MS; POS; 60 V
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$NAME: Hydroxyhaloperidol CH$COMPOUND_CLASS: N/A CH$FORMULA: C21H25ClFNO2 CH$EXACT_MASS: 377.15578 CH$SMILES: Fc(c3)ccc(c3)C(O)CCCN(C2)CCC(O)(C2)c(c1)ccc(Cl)c1 CH$IUPAC: InChI=1S/C21H25ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,20,25-26H,1-2,11-15H2 CH$LINK: CAS 34104-67-1
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 13.730 min AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-01ot-0916000000-4d480edba0ac4925affe PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 109 74 74 123 27 27 129 24 24 147 20 20 149 999 999 150 90 90 165 106 106 178 12 12 194 86 86 196 39 39 204 24 24 206 121 121 207 12 12 208 16 16 224 63 63 226 20 20 326 20 20 342 125 125 343 20 20 344 51 51 360 458 458 361 86 86 362 172 172 363 27 27 378 102 102 379 20 20 380 35 35 //