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Diethyl 5,6-dimethyl-7-(1'-methylethyl)heptalene-1,2-bis(prop-2'-enoate)
SpectraBase Compound ID AkaFCu9g2pg
InChI InChI=1S/C27H32O4/c1-7-30-25(28)16-14-21-13-12-19(5)27-20(6)22(18(3)4)10-9-11-24(27)23(21)15-17-26(29)31-8-2/h9-18H,7-8H2,1-6H3/b16-14+,17-15+
InChIKey PYGUFCCYNXAVBN-YXLFCKQPSA-N
Mol Weight 420.5 g/mol
Molecular Formula C27H32O4
Exact Mass 420.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIFCxL1NaIu
Name Diethyl 5,6-dimethyl-7-(1'-methylethyl)heptalene-1,2-bis(prop-2'-enoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32O4
InChI InChI=1S/C27H32O4/c1-7-30-25(28)16-14-21-13-12-19(5)27-20(6)22(18(3)4)10-9-11-24(27)23(21)15-17-26(29)31-8-2/h9-18H,7-8H2,1-6H3/b16-14+,17-15+
InChIKey PYGUFCCYNXAVBN-YXLFCKQPSA-N
Molecular Weight 420.549 g/mol
SMILES C=12C(=C(C(C(C)C)=CC=C2)C)C(=CC=C(C1\C=C\C(=O)OCC)\C=C\C(=O)OCC)C
SPLASH splash10-00di-0087900000-2c355df9e4cad57833ca
Source of Spectrum H-85-1136-6
Synonyms Ethyl (2E)-3-{1-[(1E)-3-ethoxy-3-oxo-1-propenyl]-7-isopropyl-5,6-dimethyl-2-heptalenyl}-2-propenoate
Wiley ID 1524322