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Dimethyl 7-isopropyl-4-(E)-[(2'-(4"-methoxyphenyl)ethenyl]azulene-1,2-dicarboxylate
SpectraBase Compound ID JEsjoTLq7gB
InChI InChI=1S/C26H26O5/c1-16(2)19-11-10-18(9-6-17-7-12-20(29-3)13-8-17)21-15-23(25(27)30-4)24(22(21)14-19)26(28)31-5/h6-16H,1-5H3/b9-6+
InChIKey ZPFYJWXQPRRGNK-RMKNXTFCSA-N
Mol Weight 418.49 g/mol
Molecular Formula C26H26O5
Exact Mass 418.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVI4OXzm5i0
Name Dimethyl 7-isopropyl-4-(E)-[(2'-(4"-methoxyphenyl)ethenyl]azulene-1,2-dicarboxylate
Alternate Name(s) Dimethyl 7-isopropyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]-1,2-azulenedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O5
InChI InChI=1S/C26H26O5/c1-16(2)19-11-10-18(9-6-17-7-12-20(29-3)13-8-17)21-15-23(25(27)30-4)24(22(21)14-19)26(28)31-5/h6-16H,1-5H3/b9-6+
InChIKey ZPFYJWXQPRRGNK-RMKNXTFCSA-N
Molecular Weight 418.489 g/mol
SMILES c12c(c(C(=O)OC)cc2c(ccc(c1)C(C)C)\C=C\c1ccc(cc1)OC)C(=O)OC
SPLASH splash10-066r-0009600000-b59a44ba51af8583b3ce
Source of Spectrum H-77-1967-0
Wiley ID 1377364