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1,4b,5,6,7,7a-Hexahydro-1,3-dimethyl-pentaleno(2,1-D)pyrimidine-2,4,8(3H)-trione
SpectraBase Compound ID CMkGu3Wfz3H
InChI InChI=1S/C12H14N2O3/c1-13-9-8(11(16)14(2)12(13)17)6-4-3-5-7(6)10(9)15/h6-7H,3-5H2,1-2H3
InChIKey FCQRKQMKXKZHAA-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C12H14N2O3
Exact Mass 234.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFdo1qGbrBA
Name 1,4b,5,6,7,7a-Hexahydro-1,3-dimethyl-pentaleno(2,1-D)pyrimidine-2,4,8(3H)-trione
CAS Registry Number 75156-43-3
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14N2O3
InChI InChI=1S/C12H14N2O3/c1-13-9-8(11(16)14(2)12(13)17)6-4-3-5-7(6)10(9)15/h6-7H,3-5H2,1-2H3
InChIKey FCQRKQMKXKZHAA-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference I. Saito, K. Shimozono, T. Matsuura, J. Am. Chem. Soc. 105, 963 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3