MassBank Record: WA001530



 Glipizide; LC-ESI-Q; MS; POS; 90 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA001530
RECORD_TITLE: Glipizide; 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: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Glipizide CH$COMPOUND_CLASS: N/A CH$FORMULA: C21H27N5O4S CH$EXACT_MASS: 445.17838 CH$SMILES: Cc(c3)ncc(n3)C(=O)NCCc(c2)ccc(c2)S(=O)(=O)NC(=O)NC(C1)CCCC1 CH$IUPAC: InChI=1S/C21H27N5O4S/c1-15-13-24-19(14-23-15)20(27)22-12-11-16-7-9-18(10-8-16)31(29,30)26-21(28)25-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,22,27)(H2,25,26,28) CH$LINK: CAS 29094-61-9
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 15.820 min AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: SAMPLING_CONE 90 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0udi-0910000000-7e28ac1ead9cb0c09846 PK$NUM_PEAK: 98 PK$PEAK: m/z int. rel.int. 102 24 24 103 999 999 104 153 153 105 47 47 107 129 129 108 12 12 109 20 20 111 223 223 112 12 12 115 8 8 117 12 12 118 110 110 119 153 153 120 149 149 121 290 290 122 39 39 123 20 20 128 12 12 129 8 8 131 180 180 132 24 24 134 86 86 135 12 12 136 12 12 137 8 8 138 8 8 139 67 67 144 51 51 145 12 12 146 12 12 148 35 35 149 20 20 150 161 161 151 27 27 154 8 8 155 12 12 156 8 8 158 8 8 166 20 20 167 165 165 168 24 24 169 16 16 170 8 8 171 8 8 173 20 20 175 16 16 180 24 24 181 8 8 182 12 12 183 110 110 184 47 47 185 8 8 191 8 8 195 31 31 196 8 8 197 12 12 201 8 8 203 24 24 207 24 24 208 8 8 210 16 16 211 47 47 212 8 8 220 24 24 221 8 8 222 86 86 223 24 24 238 27 27 239 8 8 240 35 35 241 8 8 246 12 12 256 16 16 258 12 12 286 78 78 287 12 12 304 16 16 321 24 24 327 12 12 343 20 20 347 8 8 353 8 8 359 8 8 369 63 63 370 12 12 385 35 35 444 24 24 445 8 8 446 24 24 452 12 12 468 114 114 469 20 20 470 8 8 484 90 90 485 16 16 486 16 16 490 12 12 500 8 8 //