ACCESSION: MSBNK-Waters-WA001421
RECORD_TITLE: Losartan; LC-ESI-Q; MS; POS; 30 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Losartan
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₂H₂₃ClN₆O
CH$EXACT_MASS: 422.16219
CH$SMILES: CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)CO)Cl
CH$IUPAC: InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)
CH$LINK: CAS 114798-26-4
CH$LINK: INCHIKEY PSIFNNKUMBGKDQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7023227

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 15.680 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 30 V

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

PK$SPLASH: splash10-0a4i-0022900000-a88b5048035bcd5120e3
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  117 8 8
  171 35 35
  173 12 12
  189 12 12
  192 24 24
  193 8 8
  195 12 12
  207 572 572
  208 71 71
  212 8 8
  235 67 67
  236 8 8
  242 16 16
  258 8 8
  341 43 43
  342 12 12
  362 20 20
  365 31 31
  367 8 8
  377 357 357
  378 86 86
  379 149 149
  380 27 27
  383 8 8
  393 47 47
  394 8 8
  395 24 24
  405 999 999
  406 239 239
  407 384 384
  408 67 67
  409 8 8
  423 725 725
  424 157 157
  425 251 251
  426 55 55
  445 74 74
  446 12 12
  447 27 27
  461 35 35
  462 8 8
  463 20 20
//