ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003190
RECORD_TITLE: TRIAMTERENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YOSHIZUMI H, FAC. OF PHARMACY, MEIJO UNIV.
LICENSE: CC BY-NC-SA

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$LINK: INCHIKEY FNYLWPVRPXGIIP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6021373

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0udi-0090000000-c8bbcf103f5a3fdfebb5
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  240 2 20
  250 6 60
  252 1 10
  254 99.99 999
  255 16 160
  256 1 10
//