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(2E,4E,10E)-11-(1,3-benzodioxol-5-yl)undeca-2,4,10-trienoic acid ethyl ester

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(2E,4E,10E)-11-(1,3-benzodioxol-5-yl)undeca-2,4,10-trienoic acid ethyl ester
SpectraBase Compound ID 1rDfgfd4zPd
InChI InChI=1S/C20H24O4/c1-2-22-20(21)12-10-8-6-4-3-5-7-9-11-17-13-14-18-19(15-17)24-16-23-18/h6,8-15H,2-5,7,16H2,1H3/b8-6+,11-9+,12-10+
InChIKey BIZBKFFBUQMWAZ-ADDDGJNWSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JU5LjNYe8Oq
Name (2E,4E,10E)-11-(1,3-Benzodioxol-5-yl)undeca-2,4,10-trienoic acid ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.167459249 u
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-2-22-20(21)12-10-8-6-4-3-5-7-9-11-17-13-14-18-19(15-17)24-16-23-18/h6,8-15H,2-5,7,16H2,1H3/b8-6+,11-9+,12-10+
InChIKey BIZBKFFBUQMWAZ-ADDDGJNWSA-N
Molecular Weight 328.408 g/mol
SMILES C=12C(OCO2)=CC=C(\C=C\CCCC\C=C\C=C\C(=O)OCC)C1