MassBank Record: WA002811



 Norfludiazepam; LC-ESI-Q; MS; POS; 75 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002811
RECORD_TITLE: Norfludiazepam; LC-ESI-Q; MS; POS; 75 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2012.10.22)
AUTHORS: Nihon Waters K.K.
LICENSE: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Norfludiazepam CH$NAME: Desalkylflurazepam CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H10ClFN2O CH$EXACT_MASS: 288.04657 CH$SMILES: O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)c(F)ccc1 CH$IUPAC: InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20) CH$LINK: CAS 2886-65-9
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 17.900 min AC$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$CHROMATOGRAPHY: SAMPLING_CONE 75 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0006-0970000000-b9c860d9296e94f7e685 PK$NUM_PEAK: 82 PK$PEAK: m/z int. rel.int. 104 43 43 105 51 51 106 8 8 109 196 196 110 8 8 113 51 51 115 12 12 118 27 27 122 31 31 123 39 39 124 27 27 126 12 12 130 31 31 131 8 8 133 24 24 134 47 47 136 12 12 138 43 43 140 999 999 141 35 35 142 341 341 143 20 20 150 43 43 152 8 8 154 12 12 158 59 59 162 12 12 163 16 16 165 274 274 166 114 114 167 106 106 168 51 51 170 12 12 177 16 16 179 59 59 180 8 8 181 59 59 183 35 35 191 12 12 193 16 16 196 8 8 197 8 8 198 43 43 199 20 20 205 47 47 206 180 180 207 31 31 208 16 16 209 27 27 210 8 8 211 86 86 212 16 16 214 215 215 215 20 20 216 71 71 217 16 16 224 16 16 225 74 74 226 639 639 227 86 86 228 16 16 232 31 31 234 39 39 235 8 8 236 24 24 237 12 12 241 20 20 244 20 20 245 24 24 246 8 8 247 8 8 254 8 8 259 31 31 260 39 39 261 110 110 262 20 20 263 27 27 271 12 12 289 400 400 290 55 55 291 145 145 292 16 16 //