MassBank Record: MSBNK-Waters-WA000888
ACCESSION: MSBNK-Waters-WA000888
RECORD_TITLE: Norclobazam; LC-ESI-Q; MS; POS; 75 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Norclobazam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H11ClN2O2
CH$EXACT_MASS: 286.05091
CH$SMILES: O=C(C2)Nc(c3)c(cc(Cl)c3)N(C(=O)2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H11ClN2O2/c16-10-6-7-12-13(8-10)18(11-4-2-1-3-5-11)15(20)9-14(19)17-12/h1-8H,9H2,(H,17,19)
CH$LINK: CAS
22316-55-8
CH$LINK: INCHIKEY
RRTVVRIFVKKTJK-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID40176859
AC$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$CHROMATOGRAPHY: RETENTION_TIME 15.400 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 75 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0002-0190000000-dc58c3f9441491276277
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
105 141 141
106 8 8
118 12 12
122 8 8
127 8 8
133 8 8
140 12 12
167 118 118
168 35 35
169 31 31
181 47 47
182 43 43
200 8 8
202 8 8
209 12 12
210 611 611
211 63 63
216 82 82
217 24 24
218 31 31
219 12 12
228 16 16
245 999 999
246 102 102
247 372 372
248 20 20
286 8 8
287 47 47
289 12 12
309 31 31
311 12 12
325 8 8
350 12 12
//
system version 2.2.8-SNAPSHOT