ACCESSION: MSBNK-Waters-WA000743
RECORD_TITLE: Nordazepam; 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$NAME: Nordazepam
CH$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 75 V

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

PK$SPLASH: splash10-066u-0940000000-27bb98e857e3c5098b83
PK$NUM_PEAK: 80
PK$PEAK: m/z int. rel.int.
  103 27 27
  104 176 176
  105 145 145
  106 20 20
  111 8 8
  113 78 78
  114 8 8
  115 24 24
  116 184 184
  117 47 47
  118 51 51
  124 8 8
  126 8 8
  127 71 71
  129 59 59
  130 43 43
  131 8 8
  132 12 12
  133 35 35
  138 129 129
  140 999 999
  141 35 35
  142 35 35
  144 8 8
  145 8 8
  150 39 39
  151 16 16
  152 31 31
  153 16 16
  157 16 16
  158 149 149
  159 8 8
  163 16 16
  164 12 12
  165 650 650
  166 118 118
  167 219 219
  168 47 47
  170 8 8
  178 24 24
  179 35 35
  180 153 153
  181 90 90
  182 12 12
  190 63 63
  191 141 141
  192 39 39
  193 114 114
  194 20 20
  195 12 12
  199 27 27
  201 12 12
  206 67 67
  207 204 204
  208 662 662
  209 90 90
  210 8 8
  214 82 82
  215 8 8
  216 55 55
  217 12 12
  218 55 55
  219 27 27
  226 94 94
  227 43 43
  228 43 43
  229 20 20
  235 20 20
  236 8 8
  241 67 67
  243 82 82
  244 20 20
  245 20 20
  253 8 8
  271 168 168
  272 20 20
  273 55 55
  274 8 8
  293 12 12
  309 12 12
//