ACCESSION: MSBNK-Waters-WA002465
RECORD_TITLE: Prazosin; 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: CC BY-NC

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$LINK: CAS 19216-56-9
CH$LINK: INCHIKEY IENZQIKPVFGBNW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4049082

AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 12.550 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 75 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-001j-0292000000-c0d76237f9181783801b
PK$NUM_PEAK: 56
PK$PEAK: m/z int. rel.int.
  120 118 118
  138 470 470
  139 27 27
  164 161 161
  165 16 16
  174 12 12
  177 16 16
  186 12 12
  189 16 16
  201 12 12
  202 20 20
  203 125 125
  204 82 82
  205 98 98
  206 31 31
  217 31 31
  219 24 24
  220 35 35
  221 114 114
  222 47 47
  229 35 35
  230 12 12
  231 494 494
  232 286 286
  233 165 165
  234 20 20
  245 114 114
  247 999 999
  248 145 145
  249 12 12
  255 12 12
  257 59 59
  258 20 20
  259 31 31
  260 12 12
  271 12 12
  272 27 27
  273 43 43
  274 31 31
  288 51 51
  300 24 24
  315 16 16
  316 31 31
  322 20 20
  325 31 31
  326 12 12
  340 24 24
  341 51 51
  350 86 86
  351 24 24
  366 102 102
  367 12 12
  368 172 172
  369 51 51
  384 337 337
  385 67 67
//