MassBank Record: MSBNK-Waters-WA002733
ACCESSION: MSBNK-Waters-WA002733
RECORD_TITLE: Fipexide; LC-ESI-Q; MS; POS; 15 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Fipexide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H21ClN2O4
CH$EXACT_MASS: 388.11898
CH$SMILES: Clc(c4)ccc(c4)OCC(=O)N(C3)CCN(C3)Cc(c1)cc(O2)c(OC2)c1
CH$IUPAC: InChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2
CH$LINK: CAS
34161-24-5
CH$LINK: INCHIKEY
BFUJHVVEMMWLHC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5044657
AC$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$CHROMATOGRAPHY: RETENTION_TIME 14.400 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 15 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-000i-0219000000-757e6045fb60f03ce20f
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
135 411 411
136 16 16
219 12 12
242 82 82
243 12 12
253 31 31
255 31 31
265 71 71
266 12 12
271 47 47
273 16 16
355 12 12
371 31 31
389 999 999
390 184 184
391 360 360
392 67 67
411 12 12
412 20 20
//