MassBank Record: MSBNK-Waters-WA001230
ACCESSION: MSBNK-Waters-WA001230
RECORD_TITLE: Oxprenolol; 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: CC BY-NC
CH$NAME: Oxprenolol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H23NO3
CH$EXACT_MASS: 265.16779
CH$SMILES: C=CCOc(c1)c(ccc1)OCC(O)CNC(C)C
CH$IUPAC: InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3
CH$LINK: CAS
6452-71-7
CH$LINK: INCHIKEY
CEMAWMOMDPGJMB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1043835
AC$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$CHROMATOGRAPHY: RETENTION_TIME 10.000 min
AC$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: splash10-014i-0910000000-4c84d822dfa16f87ee91
PK$NUM_PEAK: 73
PK$PEAK: m/z int. rel.int.
100 176 176
102 74 74
103 98 98
105 411 411
106 12 12
107 270 270
108 20 20
109 20 20
110 78 78
113 24 24
114 12 12
115 39 39
116 999 999
117 121 121
118 12 12
119 55 55
120 16 16
121 208 208
122 67 67
123 133 133
124 27 27
127 31 31
128 24 24
129 12 12
131 98 98
132 24 24
133 192 192
134 12 12
135 212 212
136 31 31
137 12 12
143 24 24
145 78 78
146 12 12
147 168 168
148 118 118
149 78 78
150 8 8
151 12 12
153 12 12
159 43 43
161 67 67
162 12 12
163 47 47
164 12 12
166 27 27
171 8 8
175 31 31
177 55 55
183 8 8
184 63 63
185 8 8
189 74 74
190 8 8
192 12 12
203 8 8
206 35 35
207 8 8
210 90 90
211 8 8
221 16 16
224 16 16
225 82 82
226 8 8
244 8 8
247 8 8
248 16 16
252 8 8
266 372 372
267 43 43
268 8 8
274 20 20
288 24 24
//