MassBank Record: WA000888

Home Search Record Index

Norclobazam; LC-ESI-Q; MS; POS; 75 V

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: 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: 286.05090999999998757630237378180027008056640625
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: COMPTOX DTXSID40176859
CH$LINK: INCHIKEY RRTVVRIFVKKTJK-UHFFFAOYSA-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: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: RETENTION_TIME 15.400 min
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
//