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hexahydro-2H-azepine-delta^2,alpha-malonic acid, cyclic isopropylidene ester
SpectraBase Compound ID GPUYAuNxS0B
InChI InChI=1S/C12H17NO4/c1-12(2)16-10(14)9(11(15)17-12)8-6-4-3-5-7-13-8/h13H,3-7H2,1-2H3
InChIKey IBOQRIWQBFOIGL-UHFFFAOYSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample J. P. Celerier, University of Pierre and Marie Curie, Paris, France
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample J. P. Celerier, University of Pierre and Marie Curie, Paris, France
Technique KBr WAFER
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-44-3089-0
  • HEXAHYDRO-2H-AZEPINE-DELTA^2^,^alpha-MALONIC ACID, CYCLIC ISOPROPYLIDENE ESTER
  • 2H-AZEPINE-D<2,A-MALONIC ACID, HEXA- HYDRO-, CYCLIC ISOPROPYLIDENE ESTER
  • 5-(2-azepanylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione

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