MassBank Record: WA002868



 2,5-Dimethoxy-4-bromoamphetamine; LC-ESI-Q; MS; POS; 45 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002868
RECORD_TITLE: 2,5-Dimethoxy-4-bromoamphetamine; 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$NAME: 2,5-Dimethoxy-4-bromoamphetamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H16BrNO2 CH$EXACT_MASS: 273.03644 CH$SMILES: CC(N)Cc(c1)c(OC)cc(Br)c(OC)1 CH$IUPAC: InChI=1S/C11H16BrNO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3 CH$LINK: CAS 32156-26-6 CH$LINK: INCHIKEY FXMWUTGUCAKGQL-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 12.600 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$SPLASH: splash10-056u-0390000000-dc19f8e899ab46b07d26 PK$NUM_PEAK: 33 PK$PEAK: m/z int. rel.int. 106 20 20 108 125 125 122 43 43 133 98 98 135 27 27 147 8 8 149 27 27 150 71 71 151 27 27 163 114 114 164 20 20 178 999 999 179 106 106 180 8 8 195 12 12 199 27 27 201 39 39 203 12 12 223 47 47 227 20 20 229 784 784 231 780 780 232 35 35 236 8 8 240 392 392 242 278 278 244 231 231 245 12 12 257 737 737 259 776 776 260 51 51 274 47 47 276 47 47 //