MassBank Record: MSBNK-Waters-WA001022
ACCESSION: MSBNK-Waters-WA001022
RECORD_TITLE: Gliclazide; LC-ESI-Q; MS; POS; 60 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Gliclazide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H21N3O3S
CH$EXACT_MASS: 323.13036
CH$SMILES: Cc(c3)ccc(c3)S(=O)(=O)NC(=O)NN(C1)CC(C2)C(CC2)1
CH$IUPAC: InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)
CH$LINK: CAS
21187-98-4
CH$LINK: INCHIKEY
BOVGTQGAOIONJV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9023095
AC$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$CHROMATOGRAPHY: RETENTION_TIME 17.000 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-03fr-0900000000-6025658b83864a8fbb41
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
108 12 12
109 12 12
110 999 999
111 184 184
112 8 8
119 47 47
125 125 125
127 501 501
128 31 31
132 20 20
149 16 16
151 59 59
153 180 180
155 74 74
168 47 47
169 27 27
172 12 12
220 20 20
324 67 67
325 12 12
346 86 86
347 16 16
362 27 27
//
system version 2.2.6-SNAPSHOT