MassBank Record: WA000545



 Flumazenil; LC-ESI-Q; MS; POS; 60 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000545
RECORD_TITLE: Flumazenil; LC-ESI-Q; MS; POS; 60 V
DATE: 2016.01.19 (2008.09.25, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Flumazenil CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H14FN3O3 CH$EXACT_MASS: 303.10192 CH$SMILES: CCOC(=O)c(n3)c(C1)n(c3)c(c2)c(cc(F)c2)C(=O)N(C)1 CH$IUPAC: InChI=1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3 CH$LINK: CAS 78755-81-4 CH$LINK: INCHIKEY OFBIFZUFASYYRE-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID2023064
AC$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$CHROMATOGRAPHY: RETENTION_TIME 13.440 min AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-056r-0090000000-9e6688eb40a3fc165e88 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 148 12 12 162 24 24 173 12 12 175 8 8 189 125 125 190 8 8 201 51 51 202 8 8 203 86 86 215 12 12 217 713 713 218 63 63 229 278 278 230 129 129 231 24 24 233 20 20 241 43 43 258 854 854 259 94 94 260 8 8 276 999 999 277 110 110 278 12 12 304 71 71 305 8 8 326 102 102 327 12 12 367 24 24 629 8 8 //

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