ACCESSION: MSBNK-Waters-WA002812
RECORD_TITLE: Norfludiazepam; LC-ESI-Q; MS; POS; 60 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 60 V

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

PK$SPLASH: splash10-000f-0390000000-ee0e047fd5c5cf8a5062
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
  109 59 59
  122 8 8
  123 31 31
  124 31 31
  133 12 12
  134 16 16
  140 439 439
  141 20 20
  142 145 145
  143 8 8
  150 12 12
  154 12 12
  158 16 16
  162 8 8
  165 98 98
  166 63 63
  167 31 31
  168 39 39
  170 8 8
  181 31 31
  183 8 8
  193 16 16
  205 12 12
  206 39 39
  209 8 8
  211 47 47
  214 67 67
  216 24 24
  225 24 24
  226 329 329
  227 39 39
  232 12 12
  234 20 20
  236 12 12
  237 8 8
  241 8 8
  244 8 8
  245 8 8
  246 8 8
  254 12 12
  259 8 8
  260 27 27
  261 161 161
  262 20 20
  263 47 47
  264 8 8
  271 12 12
  289 999 999
  290 129 129
  291 364 364
  292 47 47
//