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1,3-Diethoxy-4-keto-cyclobut-2-ene-1-carbonitrile
SpectraBase Compound ID JooiayvlrJJ
InChI InChI=1S/C9H11NO3/c1-3-12-7-5-9(6-10,8(7)11)13-4-2/h5H,3-4H2,1-2H3
InChIKey URGSSWMBDLOCGL-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5N0xSpkwv0
Name 1,3-Diethoxy-4-keto-cyclobut-2-ene-1-carbonitrile
Alternate Name(s) 1,3-Diethoxy-4-oxidanylidene-cyclobut-2-ene-1-carbonitrile 1,3-Diethoxy-4-oxo-1-cyclobut-2-enecarbonitrile 1,3-Diethoxy-4-oxo-cyclobut-2-ene-1-carbonitrile
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Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-3-12-7-5-9(6-10,8(7)11)13-4-2/h5H,3-4H2,1-2H3
InChIKey URGSSWMBDLOCGL-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES C1(C(C(=C1)OCC)=O)(C#N)OCC
SPLASH splash10-004j-6900000000-bd71f5f386e777cf9f76
Source of Spectrum SO-0-572-7
Wiley ID 1545619