MassBank Record: WA000333



 Zopiclone; LC-ESI-Q; MS; POS; 30 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000333
RECORD_TITLE: Zopiclone; 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: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Zopiclone CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H17ClN6O3 CH$EXACT_MASS: 388.10507 CH$SMILES: CN(C4)CCN(C4)C(=O)OC(c21)N(c(c3)ncc(Cl)c3)C(=O)c(nccn2)1 CH$IUPAC: InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3 CH$LINK: CAS 43200-80-2
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 11.510 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 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0002-0095100000-4078510afe318b2c4bd6 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 100 8 8 101 27 27 143 133 133 217 24 24 245 999 999 246 86 86 247 384 384 248 35 35 249 16 16 263 102 102 264 8 8 265 35 35 286 8 8 345 388 388 346 63 63 347 149 149 348 20 20 389 270 270 390 35 35 391 102 102 392 16 16 411 74 74 412 12 12 413 35 35 427 67 67 428 8 8 429 27 27 //