MassBank Record: MSBNK-Waters-WA000723
ACCESSION: MSBNK-Waters-WA000723
RECORD_TITLE: Oxcarbazepine; LC-ESI-Q; MS; POS; 30 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$CHROMATOGRAPHY: SAMPLING_CONE 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0udi-0090000000-9721308410cb1455a833
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
163 8 8
180 16 16
208 35 35
210 39 39
236 431 431
237 63 63
253 999 999
254 145 145
255 12 12
275 82 82
276 12 12
291 8 8
316 8 8
505 8 8
527 8 8
//