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MassBank Record: WA000609

Trimipramine; LC-ESI-Q; MS; POS; 75 V

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: WA000609
RECORD_TITLE: Trimipramine; LC-ESI-Q; MS; POS; 75 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Trimipramine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H26N2
CH$EXACT_MASS: 294.20960
CH$SMILES: CN(C)CC(C)CN(c21)c(c3)c(ccc3)CCc(cccc2)1
CH$IUPAC: InChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3
CH$LINK: CAS 739-71-9
CH$LINK: INCHIKEY ZSCDBOWYZJWBIY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8023715

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 15.020 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 75 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-0k96-0940000000-8914d856c4b33e2bbae6
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  100 799 799
  101 43 43
  105 12 12
  118 12 12
  130 8 8
  132 8 8
  167 12 12
  178 8 8
  180 27 27
  192 12 12
  193 999 999
  194 133 133
  195 16 16
  196 8 8
  206 20 20
  207 8 8
  208 740 740
  209 94 94
  220 12 12
  234 31 31
  250 20 20
  295 188 188
  296 31 31
//

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