ACCESSION: MSBNK-Waters-WA001231
RECORD_TITLE: Oxprenolol; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Oxprenolol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₃NO₃
CH$EXACT_MASS: 265.16779
CH$SMILES: C=CCOc(c1)c(ccc1)OCC(O)CNC(C)C
CH$IUPAC: InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3
CH$LINK: CAS 6452-71-7
CH$LINK: INCHIKEY CEMAWMOMDPGJMB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1043835

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 10.000 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 45 V

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

PK$SPLASH: splash10-014i-0970000000-d467c684dd01ea3f7a1b
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  100 31 31
  102 71 71
  105 35 35
  107 31 31
  113 12 12
  114 8 8
  116 999 999
  117 63 63
  119 12 12
  123 20 20
  131 20 20
  132 12 12
  133 51 51
  134 8 8
  135 39 39
  143 12 12
  145 27 27
  147 78 78
  148 27 27
  149 27 27
  159 27 27
  161 35 35
  163 55 55
  164 8 8
  166 8 8
  171 8 8
  175 8 8
  177 31 31
  178 8 8
  184 47 47
  189 106 106
  190 12 12
  206 74 74
  207 16 16
  208 8 8
  210 31 31
  221 8 8
  224 35 35
  225 302 302
  226 39 39
  248 71 71
  249 8 8
  266 768 768
  267 114 114
  268 12 12
  274 8 8
  288 16 16
//