ACCESSION: MSBNK-Waters-WA001419
RECORD_TITLE: Losartan; 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$NAME: Losartan
CH$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 75 V

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

PK$SPLASH: splash10-0a4i-0950000000-1ea631a458f2512087b6
PK$NUM_PEAK: 63
PK$PEAK: m/z int. rel.int.
  102 20 20
  104 12 12
  105 12 12
  107 12 12
  108 35 35
  115 16 16
  118 59 59
  129 51 51
  135 27 27
  139 8 8
  140 20 20
  142 121 121
  143 12 12
  144 39 39
  151 27 27
  152 172 172
  153 196 196
  154 35 35
  155 8 8
  163 31 31
  164 16 16
  165 161 161
  166 51 51
  167 55 55
  168 16 16
  169 20 20
  170 8 8
  171 106 106
  172 8 8
  173 27 27
  177 20 20
  178 192 192
  179 239 239
  180 768 768
  181 121 121
  182 8 8
  190 274 274
  191 118 118
  192 548 548
  193 74 74
  194 8 8
  195 27 27
  196 51 51
  205 423 423
  206 521 521
  207 999 999
  208 165 165
  209 12 12
  212 8 8
  219 31 31
  231 12 12
  233 31 31
  241 8 8
  258 12 12
  405 12 12
  423 94 94
  424 16 16
  425 39 39
  426 8 8
  445 27 27
  447 8 8
  461 47 47
  463 20 20
//