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6-(4-Methoxy-phenyl)-1,3-bis(methylsulfonyl)-5-piperidino-hexahydro-1,3,5-triazine-2,4-dione
SpectraBase Compound ID 9u1VE05ygOw
InChI InChI=1S/C17H24N4O7S2/c1-28-14-9-7-13(8-10-14)15-19(18-11-5-4-6-12-18)16(22)21(30(3,26)27)17(23)20(15)29(2,24)25/h7-10,15H,4-6,11-12H2,1-3H3
InChIKey IZHNPASXWREYBU-UHFFFAOYSA-N
Mol Weight 460.52 g/mol
Molecular Formula C17H24N4O7S2
Exact Mass 460.108641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVDyQquJqdN
Name 6-(4-Methoxy-phenyl)-1,3-bis(methylsulfonyl)-5-piperidino-hexahydro-1,3,5-triazine-2,4-dione
CAS Registry Number 112081-05-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H24N4O7S2
InChI InChI=1S/C17H24N4O7S2/c1-28-14-9-7-13(8-10-14)15-19(18-11-5-4-6-12-18)16(22)21(30(3,26)27)17(23)20(15)29(2,24)25/h7-10,15H,4-6,11-12H2,1-3H3
InChIKey IZHNPASXWREYBU-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference R. Brehme, B. Stroede, J. Prakt. Chem. 329, 246 (1987).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3