MassBank Record: WA001790



 Bepridil; LC-ESI-Q; MS; POS; 75 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA001790
RECORD_TITLE: Bepridil; LC-ESI-Q; MS; POS; 75 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$NAME: Bepridil CH$COMPOUND_CLASS: N/A CH$FORMULA: C24H34N2O CH$EXACT_MASS: 366.26711 CH$SMILES: CC(C)COCC(CN(Cc(c3)cccc3)c(c2)cccc2)N(C1)CCC1 CH$IUPAC: InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3 CH$LINK: CAS 64706-54-3
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 17.200 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 75 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-03di-0900000000-13e9bb331ead3c8ef7bb PK$NUM_PEAK: 44 PK$PEAK: m/z int. rel.int. 104 39 39 106 208 208 107 16 16 108 27 27 110 999 999 111 82 82 112 106 106 114 603 603 115 43 43 117 78 78 118 309 309 119 20 20 120 133 133 122 8 8 126 20 20 128 59 59 129 20 20 130 59 59 131 8 8 132 274 274 133 27 27 134 8 8 144 24 24 145 8 8 146 12 12 159 8 8 165 8 8 168 8 8 170 259 259 171 27 27 178 8 8 179 24 24 180 8 8 181 16 16 184 204 204 185 27 27 187 16 16 188 12 12 194 20 20 196 384 384 197 59 59 222 31 31 237 12 12 367 12 12 //