MassBank Record: WA001088

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Mirtazapine; LC-ESI-Q; MS; POS; 45 V
Mass Spectrum
Chemical Structure
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ACCESSION: WA001088
RECORD_TITLE: Mirtazapine; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Mirtazapine CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H19N3 CH$EXACT_MASS: 265.15790 CH$SMILES: CN(C4)CC(c21)N(C4)c(n3)c(ccc3)Cc(cccc2)1 CH$IUPAC: InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3 CH$LINK: CAS 61337-67-5 CH$LINK: INCHIKEY RONZAEMNMFQXRA-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID0023325
AC$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$CHROMATOGRAPHY: RETENTION_TIME 11.700 min AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$CHROMATOGRAPHY: SAMPLING_CONE 45 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-014i-0390000000-5d58b8a7402ca7787996 PK$NUM_PEAK: 11 PK$PEAK: m/z int. rel.int. 195 482 482 196 55 55 209 137 137 210 20 20 223 47 47 235 31 31 239 47 47 264 20 20 266 999 999 267 157 157 268 12 12 //