MassBank Record: WA002464



 Prazosin; LC-ESI-Q; MS; POS; 90 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002464
RECORD_TITLE: Prazosin; LC-ESI-Q; MS; POS; 90 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$NAME: Prazosin CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H21N5O4 CH$EXACT_MASS: 383.15935 CH$SMILES: COc(c1)c(OC)cc(c(N)4)c1nc(n4)N(C3)CCN(C3)C(=O)c(c2)occ2 CH$IUPAC: InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22) CH$LINK: CAS 19216-56-9
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 12.550 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 90 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-001i-0391000000-edffc0f2daaec9db2ec7 PK$NUM_PEAK: 72 PK$PEAK: m/z int. rel.int. 106 16 16 120 98 98 133 12 12 135 16 16 138 337 337 139 20 20 147 31 31 150 12 12 160 16 16 161 35 35 162 12 12 163 12 12 164 102 102 173 12 12 174 82 82 175 27 27 176 12 12 177 86 86 178 12 12 186 43 43 187 16 16 188 20 20 189 71 71 190 31 31 191 39 39 200 12 12 201 31 31 202 51 51 203 243 243 204 145 145 205 149 149 206 47 47 214 20 20 215 20 20 217 71 71 218 39 39 219 35 35 220 12 12 221 55 55 222 24 24 227 16 16 229 98 98 230 16 16 231 999 999 232 274 274 233 196 196 234 24 24 243 27 27 244 27 27 245 118 118 247 380 380 248 39 39 255 24 24 257 86 86 258 27 27 259 39 39 260 12 12 272 39 39 273 20 20 274 20 20 297 12 12 300 20 20 322 31 31 325 31 31 341 12 12 350 106 106 351 20 20 366 16 16 368 74 74 369 12 12 384 184 184 385 35 35 //