MassBank Record: MSBNK-Waters-WA000727
ACCESSION: MSBNK-Waters-WA000727
RECORD_TITLE: Oxazepam; 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$NAME: Oxazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H11ClN2O2
CH$EXACT_MASS: 286.05091
CH$SMILES: Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)/t15-/m0/s1
CH$LINK: CAS
604-75-1
CH$LINK: INCHIKEY
ADIMAYPTOBDMTL-HNNXBMFYSA-N
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 15.100 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$SPLASH: splash10-00kf-0090000000-ede9c4c26318af0c5bc0
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
104 63 63
128 39 39
153 8 8
156 20 20
166 35 35
168 12 12
207 8 8
231 176 176
232 24 24
233 63 63
241 999 999
243 212 212
244 31 31
258 8 8
259 8 8
269 846 846
270 118 118
271 282 282
272 39 39
287 419 419
288 47 47
289 141 141
290 24 24
309 90 90
310 12 12
311 31 31
325 35 35
327 16 16
350 12 12
573 20 20
575 12 12
595 59 59
596 20 20
597 43 43
598 12 12
599 8 8
611 16 16
613 16 16
//