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Propanedioic acid, 2,3-butadienyl-, diethyl ester
SpectraBase Compound ID 7S6UDbBYEjv
InChI InChI=1S/C11H16O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h7,9H,1,5-6,8H2,2-3H3
InChIKey TVVFDLOSUCAMEC-UHFFFAOYSA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFoebBNnZK6
Name Propanedioic acid, 2,3-butadienyl-, diethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 212.104858991 u
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h7,9H,1,5-6,8H2,2-3H3
InChIKey TVVFDLOSUCAMEC-UHFFFAOYSA-N
Molecular Weight 212.245 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)CC=C=C