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4,4-Dicyano-5-(ethoxy)tricyclo[6.2.0.0(3,7)]deca-2,9-diene isomer
SpectraBase Compound ID 7579bE2yFfk
InChI InChI=1S/C14H14N2O/c1-2-17-13-6-11-10-4-3-9(10)5-12(11)14(13,7-15)8-16/h3-5,9-11,13H,2,6H2,1H3/t9-,10-,11-,13+/m0/s1
InChIKey HFUWDKUYGJOYBI-MRBYEJRBSA-N
Mol Weight 226.28 g/mol
Molecular Formula C14H14N2O
Exact Mass 226.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPkAEDgE1oR
Name 4,4-Dicyano-5-(ethoxy)tricyclo[6.2.0.0(3,7)]deca-2,9-diene isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O
InChI InChI=1S/C14H14N2O/c1-2-17-13-6-11-10-4-3-9(10)5-12(11)14(13,7-15)8-16/h3-5,9-11,13H,2,6H2,1H3/t9-,10-,11-,13+/m0/s1
InChIKey HFUWDKUYGJOYBI-MRBYEJRBSA-N
Molecular Weight 226.279 g/mol
SMILES C=12C([C@@](OCC)([H])C[C@]2([C@]2(C=C[C@]2(C1)[H])[H])[H])(C#N)C#N
SPLASH splash10-0udi-0900000000-27d2ba889b42f4e040a0
Source of Spectrum J-57-882-10
Synonyms (2aS,2bS,4R,6aR)-4-Ethoxy-2b,3,4,6a-tetrahydro-2aH-cyclobuta[a]pentalene-5,5-dicarbonitrile 4,4-Dicyano-5-(ethoxy)tricyclo[6.2.0.0(3,7)]deca-2,9-diene 4-Ethoxy-2b,3,4,6a-tetrahydrocyclobuta[a]pentalene-5,5(2aH)-dicarbonitrile
Wiley ID 1227812