MassBank Record: MSBNK-Waters-WA000801
ACCESSION: MSBNK-Waters-WA000801
RECORD_TITLE: Glimepiride; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Glimepiride
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C24H34N4O5S
CH$EXACT_MASS: 490.22499
CH$SMILES: CC(C3)CCC(C3)NC(=O)NS(=O)(=O)c(c1)ccc(CCNC(=O)N(C2)C(=O)C(CC)=C(C)2)c1
CH$IUPAC: InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)/t16-,19-
CH$LINK: CAS
93479-97-1
CH$LINK: INCHIKEY
WIGIZIANZCJQQY-RUCARUNLSA-N
CH$LINK: COMPTOX
DTXSID5040675
AC$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$CHROMATOGRAPHY: RETENTION_TIME 18.500 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 45 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0udi-0309310000-89d4f9ebb240fe5383fc
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
114 27 27
124 16 16
126 439 439
127 27 27
157 12 12
167 24 24
335 27 27
352 999 999
353 180 180
354 67 67
355 8 8
378 24 24
491 380 380
492 74 74
493 20 20
513 59 59
514 12 12
529 59 59
530 12 12
531 8 8
//