ACCESSION: MSBNK-Waters-WA000614
RECORD_TITLE: Triamterene; 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$NAME: Triamterene
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₁N₇
CH$EXACT_MASS: 253.10759
CH$SMILES: Nc(n3)nc(n1)c(c(N)3)nc(c(c2)cccc2)c(N)1
CH$IUPAC: InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19)
CH$LINK: CAS 396-01-0
CH$LINK: INCHIKEY FNYLWPVRPXGIIP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6021373

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 10.900 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 90 V

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

PK$SPLASH: splash10-0udi-0930000000-b0e6ca22cc4b8736746e
PK$NUM_PEAK: 53
PK$PEAK: m/z int. rel.int.
  103 8 8
  104 999 999
  105 51 51
  107 31 31
  114 8 8
  116 325 325
  117 27 27
  118 27 27
  122 8 8
  128 12 12
  129 24 24
  131 71 71
  132 12 12
  133 8 8
  134 39 39
  141 357 357
  142 67 67
  143 239 239
  144 24 24
  145 86 86
  146 8 8
  153 12 12
  157 59 59
  158 16 16
  159 8 8
  166 20 20
  168 384 384
  169 43 43
  170 16 16
  182 24 24
  183 82 82
  184 24 24
  185 67 67
  186 16 16
  193 47 47
  195 255 255
  196 27 27
  198 8 8
  209 8 8
  210 153 153
  211 12 12
  212 74 74
  213 16 16
  220 51 51
  227 16 16
  234 12 12
  236 12 12
  237 462 462
  238 51 51
  252 8 8
  254 435 435
  255 47 47
  278 8 8
//