ACCESSION: MSBNK-Waters-WA000608
RECORD_TITLE: Trimipramine; LC-ESI-Q; MS; POS; 90 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 90 V

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

PK$SPLASH: splash10-0006-0920000000-ca3a7ce6f773c2ce72f0
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  100 184 184
  101 8 8
  103 8 8
  106 8 8
  115 12 12
  118 16 16
  130 12 12
  165 39 39
  166 24 24
  167 67 67
  168 8 8
  178 16 16
  179 12 12
  180 31 31
  191 12 12
  192 133 133
  193 999 999
  194 137 137
  195 8 8
  206 31 31
  207 20 20
  208 223 223
  209 24 24
  220 8 8
  234 27 27
  295 145 145
  296 24 24
//