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(1S,3R)-1,2,2-tricyano-3-(5-nitro-2-furyl)cyclopropane-1-carboxylic acid ethyl ester
SpectraBase Compound ID 6EX9MUqkX5G
InChI InChI=1S/C13H8N4O5/c1-2-21-11(18)13(7-16)10(12(13,5-14)6-15)8-3-4-9(22-8)17(19)20/h3-4,10H,2H2,1H3/t10-,13-/m1/s1
InChIKey FZQJGEXZIDQBTQ-ZWNOBZJWSA-N
Mol Weight 300.23 g/mol
Molecular Formula C13H8N4O5
Exact Mass 300.049469 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDwVl8gg723
Name (1S,3R)-1,2,2-tricyano-3-(5-nitro-2-furyl)cyclopropane-1-carboxylic acid ethyl ester
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8N4O5
InChI InChI=1S/C13H8N4O5/c1-2-21-11(18)13(7-16)10(12(13,5-14)6-15)8-3-4-9(22-8)17(19)20/h3-4,10H,2H2,1H3/t10-,13-/m1/s1
InChIKey FZQJGEXZIDQBTQ-ZWNOBZJWSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 300.230 g/mol
Source File Reference MHKO15806