ACCESSION: MSBNK-Waters-WA000722
RECORD_TITLE: Oxcarbazepine; 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$NAME: Oxcarbazepine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₂N₂O₂
CH$EXACT_MASS: 252.08988
CH$SMILES: NC(=O)N(c21)c(c3)c(ccc3)C(O)=Cc(cccc2)1
CH$IUPAC: InChI=1S/C15H12N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-9,18H,(H2,16,19)
CH$LINK: CAS 28721-07-5
CH$LINK: INCHIKEY WRIZWKOAYKZGHB-UHFFFAOYSA-N

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 13.800 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$SPLASH: splash10-052r-0190000000-799af57611b04aa09cff
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  120 16 16
  146 24 24
  180 176 176
  181 27 27
  182 67 67
  183 8 8
  192 8 8
  208 842 842
  209 106 106
  210 274 274
  211 35 35
  236 999 999
  237 141 141
  238 16 16
  253 294 294
  254 51 51
  275 82 82
  276 12 12
  291 8 8
//