MassBank Record: WA001949



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

ACCESSION: WA001949
RECORD_TITLE: Carteolol; 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$NAME: Carteolol CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H24N2O3 CH$EXACT_MASS: 292.17869 CH$SMILES: OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)NC(=O)C1 CH$IUPAC: InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20) CH$LINK: CAS 51781-06-7
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 10.590 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: splash10-0ir0-0930000000-70595326ee91b7500856 PK$NUM_PEAK: 46 PK$PEAK: m/z int. rel.int. 103 8 8 106 8 8 110 8 8 114 8 8 115 8 8 117 12 12 118 20 20 120 24 24 122 595 595 123 39 39 129 8 8 130 16 16 131 8 8 132 71 71 133 16 16 134 82 82 135 8 8 136 51 51 146 98 98 147 16 16 148 133 133 149 16 16 158 27 27 160 278 278 161 59 59 162 114 114 163 8 8 164 878 878 165 67 67 174 415 415 175 43 43 176 184 184 177 12 12 184 8 8 190 396 396 191 39 39 200 8 8 202 999 999 203 114 114 204 12 12 220 20 20 231 8 8 237 270 270 238 24 24 293 161 161 294 20 20 //