MassBank Record: WA000582



 Desipramine; LC-ESI-Q; MS; POS; 45 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000582
RECORD_TITLE: Desipramine; 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$NAME: Desipramine CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H22N2 CH$EXACT_MASS: 266.17830 CH$SMILES: CNCCCN(c21)c(c3)c(ccc3)CCc(cccc2)1 CH$IUPAC: InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3 CH$LINK: CAS 50-47-5 CH$LINK: INCHIKEY HCYAFALTSJYZDH-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID6022896
AC$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$CHROMATOGRAPHY: RETENTION_TIME 14.320 min AC$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: splash10-0aor-0190000000-e7f0f0599f110f0cd273 PK$NUM_PEAK: 19 PK$PEAK: m/z int. rel.int. 105 8 8 113 71 71 193 27 27 195 74 74 196 180 180 197 16 16 208 999 999 209 114 114 210 16 16 222 20 20 224 31 31 234 8 8 235 16 16 236 423 423 237 47 47 238 20 20 267 917 917 268 133 133 269 8 8 //

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