MassBank Record: MSBNK-Waters-WA000430
ACCESSION: MSBNK-Waters-WA000430
RECORD_TITLE: Chlorpheniramine; LC-ESI-Q; MS; POS; 75 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Chlorpheniramine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H19ClN2
CH$EXACT_MASS: 274.12368
CH$SMILES: CN(C)CCC(c(c2)nccc2)c(c1)ccc(Cl)c1
CH$IUPAC: InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
CH$LINK: CAS
132-22-9
CH$LINK: INCHIKEY
SOYKEARSMXGVTM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0022804
AC$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$CHROMATOGRAPHY: RETENTION_TIME 12.900 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 75 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0159-0950000000-e358dc5dd990224379a1
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
117 74 74
118 168 168
119 20 20
125 90 90
127 27 27
167 999 999
168 133 133
180 118 118
181 12 12
193 16 16
194 98 98
195 35 35
201 145 145
202 121 121
203 63 63
204 39 39
228 16 16
230 474 474
231 51 51
232 168 168
233 20 20
//