MassBank Record: WA001741



 10-Methoxycarbamazepine; LC-ESI-Q; MS; POS; 45 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA001741
RECORD_TITLE: 10-Methoxycarbamazepine; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: 10-Methoxycarbamazepine CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H14N2O2 CH$EXACT_MASS: 266.10553 CH$SMILES: COC(=C1)c(c3)c(ccc3)N(C(N)=O)c(c2)c(ccc2)1 CH$IUPAC: InChI=1S/C16H14N2O2/c1-20-15-10-11-6-2-4-8-13(11)18(16(17)19)14-9-5-3-7-12(14)15/h2-10H,1H3,(H2,17,19) CH$LINK: CAS 28721-09-7 CH$LINK: INCHIKEY PIZOFBKQWNPKDK-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 15.350 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$SPLASH: splash10-01b9-0190000000-60c7bc445327b19d12d6 PK$NUM_PEAK: 42 PK$PEAK: m/z int. rel.int. 103 39 39 110 20 20 112 8 8 114 8 8 117 12 12 121 43 43 123 12 12 132 12 12 133 8 8 139 12 12 145 8 8 165 35 35 166 16 16 167 16 16 179 8 8 193 215 215 194 20 20 196 31 31 210 12 12 222 110 110 223 129 129 224 521 521 225 247 247 226 78 78 227 20 20 230 8 8 233 24 24 236 35 35 250 325 325 251 82 82 254 16 16 257 8 8 265 24 24 267 999 999 268 227 227 281 63 63 289 509 509 290 110 110 291 24 24 306 8 8 307 16 16 315 8 8 //