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2-[4-(4-METHYLHEXAHYDRO-1-PYRAZINYLSULFONYL)-PHENYL]-1,3-ISOINDOLINEDIONE
SpectraBase Compound ID JfFRalwwZT9
InChI InChI=1S/C19H19N3O4S/c1-20-10-12-21(13-11-20)27(25,26)15-8-6-14(7-9-15)22-18(23)16-4-2-3-5-17(16)19(22)24/h2-9H,10-13H2,1H3
InChIKey OGKJXSOSXWDDCQ-UHFFFAOYSA-N
Mol Weight 385.44 g/mol
Molecular Formula C19H19N3O4S
Exact Mass 385.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3X0a1HLUmRH
Name 2-[4-(4-METHYLHEXAHYDRO-1-PYRAZINYLSULFONYL)-PHENYL]-1,3-ISOINDOLINEDIONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H19N3O4S
InChI InChI=1S/C19H19N3O4S/c1-20-10-12-21(13-11-20)27(25,26)15-8-6-14(7-9-15)22-18(23)16-4-2-3-5-17(16)19(22)24/h2-9H,10-13H2,1H3
InChIKey OGKJXSOSXWDDCQ-UHFFFAOYSA-N
Literature Reference Author L.M.LIMA,P.CASTRO,A.L.MACHADO,C.A.M.FRAGA,C.LUGNIER,V.L.G.D. MORAES,E.J.BARREIRO
Literature Reference Citation BIOORG.MED.CHEM.,10,3067(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00152-9
Molecular Weight 385.438 g/mol
Solvent DMSO-D6
Source File Reference UWSI24281