ACCESSION: MSBNK-Waters-WA000742
RECORD_TITLE: Nordazepam; LC-ESI-Q; MS; POS; 90 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Nordazepam
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₁ClN₂O
CH$EXACT_MASS: 270.05599
CH$SMILES: O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)
CH$LINK: CAS 1088-11-5
CH$LINK: INCHIKEY AKPLHCDWDRPJGD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2049000

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 16.000 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 90 V

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

PK$SPLASH: splash10-0pwc-0920000000-39dbd7c4d3ec16f4551b
PK$NUM_PEAK: 97
PK$PEAK: m/z int. rel.int.
  102 102 102
  103 212 212
  104 721 721
  105 439 439
  106 35 35
  111 67 67
  113 196 196
  114 51 51
  115 59 59
  116 278 278
  117 67 67
  118 200 200
  119 12 12
  120 27 27
  123 43 43
  124 55 55
  125 20 20
  126 16 16
  127 133 133
  129 192 192
  130 235 235
  131 59 59
  132 27 27
  133 31 31
  138 357 357
  139 47 47
  140 999 999
  141 59 59
  142 43 43
  143 12 12
  144 8 8
  145 20 20
  150 47 47
  151 71 71
  152 149 149
  153 78 78
  154 27 27
  155 12 12
  156 12 12
  157 31 31
  158 98 98
  159 8 8
  163 47 47
  164 67 67
  165 705 705
  166 133 133
  167 204 204
  168 39 39
  169 16 16
  170 16 16
  177 27 27
  178 94 94
  179 161 161
  180 588 588
  181 157 157
  182 20 20
  190 212 212
  191 204 204
  192 118 118
  193 125 125
  194 20 20
  199 67 67
  200 8 8
  201 39 39
  202 8 8
  203 8 8
  205 39 39
  206 196 196
  207 435 435
  208 478 478
  209 51 51
  214 121 121
  215 20 20
  216 59 59
  217 27 27
  218 43 43
  219 24 24
  220 8 8
  224 8 8
  226 43 43
  227 47 47
  228 27 27
  229 20 20
  235 16 16
  240 8 8
  241 102 102
  242 8 8
  243 39 39
  244 12 12
  271 137 137
  272 16 16
  273 47 47
  274 8 8
  293 20 20
  295 8 8
  309 24 24
  311 16 16
//