MassBank Record: MSBNK-Waters-WA000700
ACCESSION: MSBNK-Waters-WA000700
RECORD_TITLE: Prazepam; 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$NAME: Prazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H17ClN2O
CH$EXACT_MASS: 324.10294
CH$SMILES: Clc(c3)cc(C=1c(c4)cccc4)c(c3)N(CC(C2)C2)C(=O)CN1
CH$IUPAC: InChI=1S/C19H17ClN2O/c20-15-8-9-17-16(10-15)19(14-4-2-1-3-5-14)21-11-18(23)22(17)12-13-6-7-13/h1-5,8-10,13H,6-7,11-12H2
CH$LINK: CAS
2955-38-6
CH$LINK: INCHIKEY
MWQCHHACWWAQLJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4021181
AC$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$CHROMATOGRAPHY: RETENTION_TIME 18.800 min
AC$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: splash10-00b9-0079000000-1e9866c3d0dd72f1e706
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
105 12 12
241 8 8
242 8 8
255 35 35
256 8 8
257 12 12
268 20 20
271 815 815
272 114 114
273 282 282
274 39 39
297 16 16
325 999 999
326 172 172
327 353 353
328 59 59
329 8 8
//