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(1E,3E,5E)-triethyl 4-phenylhexa-1,3,5-triene-1,3,6-tricarboxylate
SpectraBase Compound ID KXt6p3HvGZs
InChI InChI=1S/C21H24O6/c1-4-25-19(22)14-12-17(16-10-8-7-9-11-16)18(21(24)27-6-3)13-15-20(23)26-5-2/h7-15H,4-6H2,1-3H3/b14-12+,15-13+,18-17+
InChIKey ZHYYRARGGXIZJZ-MVWGTZATSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jSVaYA3yEt
Name (1E,3E,5E)-triethyl 4-phenylhexa-1,3,5-triene-1,3,6-tricarboxylate
Alternate Name(s) Triethyl (1E,3E,5E)-4-phenylhexa-1,3,5-triene-1,3,6-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-4-25-19(22)14-12-17(16-10-8-7-9-11-16)18(21(24)27-6-3)13-15-20(23)26-5-2/h7-15H,4-6H2,1-3H3/b14-12+,15-13+,18-17+
InChIKey ZHYYRARGGXIZJZ-MVWGTZATSA-N
Literature Reference DOI 10.1021/jo101554r
Molecular Weight 372.417 g/mol
SMILES C(\C=C\C(=C/(C(OCC)=O)\C=C\C(OCC)=O)c1ccccc1)(=O)OCC
SPLASH splash10-0kea-2930000000-db04ab74f35635dbb291
Source of Spectrum J-75-8279/SM4-3ab
Wiley ID 1751793