MassBank Record: WA001273



 Lamotrigine; LC-ESI-Q; MS; POS; 15 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA001273
RECORD_TITLE: Lamotrigine; LC-ESI-Q; MS; POS; 15 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Lamotrigine CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H7Cl2N5 CH$EXACT_MASS: 255.00785 CH$SMILES: Nc(n2)nc(N)c(n2)c(c1)c(Cl)c(Cl)cc1 CH$IUPAC: InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16) CH$LINK: CAS 84057-84-1
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 11.700 min AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: SAMPLING_CONE 15 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0a4i-0090010000-d03b7ea9b497e504c36f PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 222 12 12 256 999 999 257 43 43 258 686 686 259 47 47 260 121 121 261 8 8 511 71 71 513 106 106 514 8 8 515 55 55 516 8 8 517 12 12 //