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MassBank Record: MSBNK-Waters-WA002813

Norfludiazepam; LC-ESI-Q; MS; POS; 15 V, 45 V

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

ACCESSION: MSBNK-Waters-WA002813
RECORD_TITLE: Norfludiazepam; LC-ESI-Q; MS; POS; 15 V, 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2012.10.22)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Norfludiazepam
CH$NAME: Desalkylflurazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H10ClFN2O
CH$EXACT_MASS: 288.04657
CH$SMILES: O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)c(F)ccc1
CH$IUPAC: InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)
CH$LINK: CAS 2886-65-9
CH$LINK: INCHIKEY UVCOILFBWYKHHB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30183057

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 17.900 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 15 V, 45 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-000i-0090000000-0d430d6831a97362d909
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  289 999 999
  290 133 133
  291 353 353
  292 47 47
//

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