MassBank Record: MSBNK-Waters-WA001262
ACCESSION: MSBNK-Waters-WA001262
RECORD_TITLE: Lormetazepam; 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$NAME: Lormetazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H12Cl2N2O2
CH$EXACT_MASS: 334.02758
CH$SMILES: Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N(C)2)c(c1)c(Cl)ccc1
CH$IUPAC: InChI=1S/C16H12Cl2N2O2/c1-20-13-7-6-9(17)8-11(13)14(19-15(21)16(20)22)10-4-2-3-5-12(10)18/h2-8,15,21H,1H3
CH$LINK: CAS
848-75-9
CH$LINK: INCHIKEY
FJIKWRGCXUCUIG-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID40862442
AC$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$CHROMATOGRAPHY: RETENTION_TIME 16.400 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-000i-0019000000-8cea71d046be0e01a7d0
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
289 247 247
290 20 20
291 176 176
292 20 20
293 27 27
317 184 184
318 24 24
319 129 129
320 20 20
321 20 20
335 999 999
336 114 114
337 693 693
338 86 86
339 114 114
340 16 16
357 137 137
358 12 12
359 98 98
360 16 16
361 16 16
373 63 63
375 51 51
376 8 8
377 12 12
398 20 20
400 16 16
//