MassBank Record: WA002327



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

ACCESSION: WA002327
RECORD_TITLE: Telmisartan; 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$NAME: Telmisartan CH$COMPOUND_CLASS: N/A CH$FORMULA: C33H30N4O2 CH$EXACT_MASS: 514.23688 CH$SMILES: n(c12)c(c(c4)cc(n(Cc(c5)ccc(c(c(C(O)=O)6)cccc6)c5)3)c(c(C)4)nc3CCC)n(C)c1cccc2 CH$IUPAC: InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39) CH$LINK: CAS 144701-48-4
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 16.600 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: splash10-004j-0292520000-b1213fcd37d6e12c8c69 PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 115 27 27 128 12 12 133 20 20 139 12 12 152 39 39 153 20 20 155 24 24 164 12 12 165 74 74 166 20 20 167 12 12 183 20 20 193 255 255 194 39 39 211 212 212 212 31 31 261 39 39 262 20 20 275 51 51 276 999 999 277 192 192 278 20 20 289 165 165 290 39 39 303 90 90 304 24 24 305 243 243 306 55 55 317 43 43 467 35 35 468 16 16 497 752 752 498 278 278 499 55 55 515 282 282 516 110 110 517 20 20 591 12 12 //