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Thiosildenafil

View entire compound with spectra: 4 NMR, 1 Raman, and 1 MS (GC)

Thiosildenafil
SpectraBase Compound ID 92jfl6GXH21
InChI InChI=1S/C22H30N6O3S2/c1-5-7-17-19-20(27(4)25-17)22(32)24-21(23-19)16-14-15(8-9-18(16)31-6-2)33(29,30)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,32)
InChIKey LJUBVCQVNMLSTQ-UHFFFAOYSA-N
Mol Weight 490.64 g/mol
Molecular Formula C22H30N6O3S2
Exact Mass 490.182081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8dFGF8E1BW
Name THIOSILDENAFIL
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30N6O3S2
InChI InChI=1S/C22H30N6O3S2/c1-5-7-17-19-20(27(4)25-17)22(32)24-21(23-19)16-14-15(8-9-18(16)31-6-2)33(29,30)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,32)
InChIKey LJUBVCQVNMLSTQ-UHFFFAOYSA-N
Literature Reference Author J.VAYSSE,V.GILARD,S.BALAYSSAC,C.ZEDDE,R.MARTINO,M.MALET-MART INO
Literature Reference Citation J.PHARM.BIOM.ANAL.,59,58(2012)
Literature Reference DOI 10.1016/j.jpba.2011.10.001
Molecular Weight 490.639 g/mol
Solvent CD3OD
Source File Reference UWMZ44026