MassBank Record: WA002385



 Perindoprilat (diacid form); LC-ESI-Q; MS; POS; 30 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002385
RECORD_TITLE: Perindoprilat (diacid form); LC-ESI-Q; MS; POS; 30 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$NAME: Perindoprilat (diacid form) CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H28N2O5 CH$EXACT_MASS: 340.19982 CH$SMILES: CCCC(C(O)=O)NC(C)C(=O)N(C(C(O)=O)1)C([H])(C2)C([H])(CCC2)C1 CH$IUPAC: InChI=1S/C17H28N2O5/c1-3-6-12(16(21)22)18-10(2)15(20)19-13-8-5-4-7-11(13)9-14(19)17(23)24/h10-14,18H,3-9H2,1-2H3,(H,21,22)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1 CH$LINK: CAS 95153-31-4
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 10.700 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 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0006-0918000000-f9508a1609c6e5d77c7c PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 101 27 27 107 20 20 109 31 31 111 16 16 113 12 12 116 12 12 122 86 86 124 67 67 126 43 43 128 16 16 142 31 31 144 219 219 145 16 16 152 20 20 155 35 35 157 12 12 170 548 548 171 43 43 172 20 20 179 12 12 251 20 20 295 94 94 296 16 16 297 20 20 341 999 999 342 188 188 343 24 24 //