MassBank Record: MSBNK-Waters-WA000787
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
//