MassBank Record: WA002569



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

ACCESSION: WA002569
RECORD_TITLE: Nicardipine; LC-ESI-Q; MS; NEG; 30 V
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Nicardipine CH$COMPOUND_CLASS: N/A CH$FORMULA: C26H29N3O6 CH$EXACT_MASS: 479.20564 CH$SMILES: c(c1)(N(=O)=O)cccc1C(C(C(=O)OC)=2)C(C(=O)OCCN(C)Cc(c3)cccc3)=C(NC2C)C CH$IUPAC: InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3 CH$LINK: CAS 55985-32-5 CH$LINK: INCHIKEY ZBBHBTPTTSWHBA-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID6023363
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: RETENTION_TIME 16.250 min AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$CHROMATOGRAPHY: SAMPLING_CONE 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-004i-0000910000-934ab7ecc214b03d7bf3 PK$NUM_PEAK: 8 PK$PEAK: m/z int. rel.int. 478 999 999 479 243 243 480 47 47 494 20 20 514 121 121 515 16 16 516 27 27 517 12 12 //

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