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Diethyl 4-ethyl-4,8,8-trimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2,2-dicarboxylate
SpectraBase Compound ID JoTlTvI3781
InChI InChI=1S/C21H34O4/c1-7-20(6)14-21(17(22)24-8-2,18(23)25-9-3)13-16-15(20)11-10-12-19(16,4)5/h7-14H2,1-6H3
InChIKey ZKSWHQGWYZRYGW-UHFFFAOYSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bKUPNa3X29
Name Diethyl 4-ethyl-4,8,8-trimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2,2-dicarboxylate
Alternate Name(s) Diethyl 4-ethyl-4,8,8-trimethyl-3,4,5,6,7,8-hexahydronaphthalene-2,2(1H)-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-7-20(6)14-21(17(22)24-8-2,18(23)25-9-3)13-16-15(20)11-10-12-19(16,4)5/h7-14H2,1-6H3
InChIKey ZKSWHQGWYZRYGW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201028f
Molecular Weight 350.499 g/mol
SMILES C1(C)(C=2CC(C(=O)OCC)(C(OCC)=O)CC(C)(C2CCC1)CC)C
SPLASH splash10-006t-1795000000-ce4ceb9e3d89a5fef23a
Source of Spectrum A1-13-3320/SMS19-2b
Wiley ID 1753257