MassBank Record: MSBNK-Waters-WA001047
ACCESSION: MSBNK-Waters-WA001047
RECORD_TITLE: Lorazepam; LC-ESI-Q; MS; POS; 30 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Lorazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H10Cl2N2O2
CH$EXACT_MASS: 320.01193
CH$SMILES: Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)c(Cl)ccc1
CH$IUPAC: InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)
CH$LINK: CAS
846-49-1
CH$LINK: INCHIKEY
DIWRORZWFLOCLC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7023225
AC$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$CHROMATOGRAPHY: RETENTION_TIME 15.200 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-00di-0009000000-aa9b1592caacc367db77
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
275 74 74
276 12 12
277 51 51
278 8 8
279 8 8
303 247 247
304 12 12
305 172 172
306 24 24
307 31 31
321 999 999
322 86 86
323 686 686
324 90 90
325 114 114
326 16 16
343 98 98
344 8 8
345 74 74
346 8 8
347 12 12
359 35 35
361 31 31
363 12 12
384 20 20
386 16 16
//