ACCESSION: MSBNK-Waters-WA000524
RECORD_TITLE: Brompheniramine; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Brompheniramine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₁₉BrN₂
CH$EXACT_MASS: 318.07316
CH$SMILES: CN(C)CCC(c(c2)nccc2)c(c1)ccc(Br)c1
CH$IUPAC: InChI=1S/C16H19BrN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
CH$LINK: CAS 86-22-6
CH$LINK: INCHIKEY ZDIGNSYAACHWNL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5022691

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 13.190 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$SPLASH: splash10-00b9-0090000000-98160c59a7e164e2359a
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  167 12 12
  196 71 71
  197 12 12
  274 983 983
  275 141 141
  276 999 999
  277 141 141
  278 12 12
  319 16 16
  321 16 16
//