MassBank Record: WA002922



 4-Hydroxypropranolol; LC-ESI-Q; MS; POS; 90 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002922
RECORD_TITLE: 4-Hydroxypropranolol; LC-ESI-Q; MS; POS; 90 V
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: 4-Hydroxypropranolol CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H21NO3 CH$EXACT_MASS: 275.15214 CH$SMILES: CC(C)NCC(O)COc(c1)c(c2)c(ccc2)c(O)c1 CH$IUPAC: InChI=1S/C16H21NO3/c1-11(2)17-9-12(18)10-20-16-8-7-15(19)13-5-3-4-6-14(13)16/h3-8,11-12,17-19H,9-10H2,1-2H3 CH$LINK: CAS 69499-28-1 CH$LINK: INCHIKEY CWEPACWBWIOYID-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 11.200 min AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$CHROMATOGRAPHY: SAMPLING_CONE 90 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-016r-0900000000-37c706bd79bc9bed8660 PK$NUM_PEAK: 44 PK$PEAK: m/z int. rel.int. 100 16 16 102 27 27 103 227 227 105 313 313 106 8 8 115 999 999 116 110 110 117 125 125 118 231 231 119 20 20 126 24 24 127 94 94 128 466 466 129 67 67 130 8 8 131 180 180 132 43 43 133 16 16 134 8 8 136 8 8 141 47 47 142 20 20 143 20 20 144 98 98 145 161 161 146 8 8 152 243 243 153 74 74 155 59 59 156 43 43 157 12 12 159 12 12 160 31 31 161 8 8 168 35 35 169 24 24 171 31 31 172 27 27 173 24 24 184 8 8 192 8 8 276 251 251 277 24 24 290 12 12 //