ACCESSION: MSBNK-Waters-WA000787
RECORD_TITLE: Indapamide; 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: CC BY-NC

CH$NAME: Indapamide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₁₆ClN₃O₃S
CH$EXACT_MASS: 365.06009
CH$SMILES: O=C(NN(C(C)2)c(c3)c(ccc3)C2)c(c1)cc(c(Cl)c1)S(N)(=O)=O
CH$IUPAC: InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)
CH$LINK: CAS 26807-65-8
CH$LINK: INCHIKEY NDDAHWYSQHTHNT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7044633

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 15.400 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 90 V

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

PK$SPLASH: splash10-0159-0900000000-f91df0fd79cd2f77f6a3
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  103 31 31
  104 12 12
  105 86 86
  106 86 86
  109 16 16
  115 24 24
  117 999 999
  118 274 274
  119 27 27
  130 90 90
  131 24 24
  132 795 795
  133 82 82
  144 12 12
  147 8 8
  218 12 12
  366 78 78
  368 27 27
  388 8 8
  404 39 39
  406 20 20
  407 8 8
  429 8 8
//