MassBank Record: MSBNK-Waters-WA001221
ACCESSION: MSBNK-Waters-WA001221
RECORD_TITLE: Pindolol; 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$NAME: Pindolol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H20N2O2
CH$EXACT_MASS: 248.15248
CH$SMILES: CC(C)NCC(COC1=CC=CC2=C1C=CN2)O
CH$IUPAC: InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3
CH$LINK: CAS
13523-86-9
CH$LINK: INCHIKEY
JZQKKSLKJUAGIC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8023476
AC$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$CHROMATOGRAPHY: RETENTION_TIME 9.400 min
AC$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: splash10-0159-0900000000-eea0f9776e8e164da2a7
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
100 55 55
104 39 39
106 78 78
107 8 8
109 8 8
114 27 27
116 999 999
117 149 149
118 266 266
119 20 20
120 12 12
122 12 12
127 8 8
129 8 8
130 59 59
132 133 133
133 16 16
134 576 576
135 39 39
136 8 8
143 12 12
144 435 435
145 51 51
146 302 302
147 27 27
148 47 47
149 12 12
150 16 16
154 16 16
155 12 12
157 20 20
158 12 12
160 71 71
161 12 12
162 12 12
170 12 12
172 251 251
173 35 35
174 20 20
175 8 8
176 12 12
186 8 8
188 12 12
203 24 24
204 8 8
221 12 12
249 90 90
250 12 12
//