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5-ETHOXY-3-ETHYL-7-METHYL-4,5,6,7-TETRAHYDROOXEPINE-4,4-DICARBONITRILE
SpectraBase Compound ID AC7hnGnMH8K
InChI InChI=1S/C13H18N2O2/c1-4-11-7-17-10(3)6-12(16-5-2)13(11,8-14)9-15/h7,10,12H,4-6H2,1-3H3
InChIKey MFRSXYSNPGWKNR-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C13H18N2O2
Exact Mass 234.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUNFyNraeqG
Name 5-ETHOXY-3-ETHYL-7-METHYL-4,5,6,7-TETRAHYDROOXEPINE-4,4-DICARBONITRILE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N2O2
InChI InChI=1S/C13H18N2O2/c1-4-11-7-17-10(3)6-12(16-5-2)13(11,8-14)9-15/h7,10,12H,4-6H2,1-3H3
InChIKey MFRSXYSNPGWKNR-UHFFFAOYSA-N
Literature Reference Author M.KOTERA,K.ISHII,O.TAMURA,M.SAKAMOTO
Literature Reference Citation J.CHEM.SOC.PERKIN-1,313(1998)
Literature Reference DOI 10.1039/a704632d
Molecular Weight 234.298 g/mol
Solvent CDCl3
Source File Reference UWGE2999