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N,N-DIMETHYL-3-(PHENYLSULFONYL)-7,8-DIHYDRO-6-H-CYCLOPENTA-[E]-PYRAZOLO-[1.5-A]-PYRIMIDIN-2-AMINE
SpectraBase Compound ID Lra0xK5f4Rd
InChI InChI=1S/C17H18N4O2S/c1-20(2)17-15(24(22,23)13-8-4-3-5-9-13)16-18-11-12-7-6-10-14(12)21(16)19-17/h3-5,8-9,11H,6-7,10H2,1-2H3
InChIKey HRRWSJGBBMAUIX-UHFFFAOYSA-N
Mol Weight 342.42 g/mol
Molecular Formula C17H18N4O2S
Exact Mass 342.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BumaY1JfQ69
Name N,N-DIMETHYL-3-(PHENYLSULFONYL)-7,8-DIHYDRO-6-H-CYCLOPENTA-[E]-PYRAZOLO-[1.5-A]-PYRIMIDIN-2-AMINE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N4O2S
InChI InChI=1S/C17H18N4O2S/c1-20(2)17-15(24(22,23)13-8-4-3-5-9-13)16-18-11-12-7-6-10-14(12)21(16)19-17/h3-5,8-9,11H,6-7,10H2,1-2H3
InChIKey HRRWSJGBBMAUIX-UHFFFAOYSA-N
Literature Reference Author A.V.IVACHTCHENKO,D.E.DMITRIEV,E.S.GOLOVINA,M.G.KADIEVA,A.G.K ORYAKOVA,V.M.KYSIL,O
Literature Reference Citation J.MED.CHEM.,53,5186(2010)
Literature Reference DOI 10.1021/jm100350r
Molecular Weight 342.416 g/mol
Solvent CDCl3
Source File Reference UWMZ47384