MassBank Record: WA002940



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

ACCESSION: WA002940
RECORD_TITLE: Ethylmorphine; LC-ESI-Q; MS; POS; 60 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$NAME: Ethylmorphine CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H23NO3 CH$EXACT_MASS: 313.16779 CH$SMILES: CCOc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(O)3)C(N(C)C2)C1 CH$IUPAC: InChI=1S/C19H23NO3/c1-3-22-15-7-4-11-10-13-12-5-6-14(21)18-19(12,8-9-20(13)2)16(11)17(15)23-18/h4-7,12-14,18,21H,3,8-10H2,1-2H3/t12-,13+,14-,18-,19-/m0/s1 CH$LINK: CAS 76-58-4
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 10.940 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 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-03di-0259000000-df3f8eee8d545a916d61 PK$NUM_PEAK: 56 PK$PEAK: m/z int. rel.int. 108 8 8 123 8 8 133 8 8 145 12 12 146 8 8 151 8 8 155 8 8 165 12 12 173 20 20 175 24 24 181 20 20 183 67 67 185 20 20 189 16 16 191 12 12 193 31 31 194 12 12 199 12 12 200 8 8 201 74 74 202 8 8 206 8 8 207 8 8 209 31 31 210 8 8 211 39 39 213 47 47 214 8 8 215 8 8 219 12 12 221 16 16 226 8 8 227 27 27 229 149 149 230 20 20 236 8 8 237 16 16 239 63 63 240 12 12 255 31 31 257 102 102 258 12 12 265 8 8 266 12 12 267 24 24 268 8 8 296 47 47 297 8 8 312 12 12 314 999 999 315 172 172 316 16 16 332 35 35 336 12 12 352 20 20 355 8 8 //