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Ethyl (1R*,4R*)-7,7-dimethoxy-8-oxobicyclo[2.2.2]octa-2,5-diene-3-carboxytlate
SpectraBase Compound ID DZMkTglOeSd
InChI InChI=1S/C13H16O5/c1-4-18-12(15)10-7-8-5-6-9(10)11(14)13(8,16-2)17-3/h5-9H,4H2,1-3H3/t8-,9-/m1/s1
InChIKey CHASPTMAZWFXLC-RKDXNWHRSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNfxFrl2Yii
Name Ethyl (1R*,4R*)-7,7-dimethoxy-8-oxobicyclo[2.2.2]octa-2,5-diene-3-carboxytlate
Alternate Name(s) (1R,4R)-ethyl 8,8-dimethoxy-7-oxobicyclo[2.2.2]octa-2,5-diene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-4-18-12(15)10-7-8-5-6-9(10)11(14)13(8,16-2)17-3/h5-9H,4H2,1-3H3/t8-,9-/m1/s1
InChIKey CHASPTMAZWFXLC-RKDXNWHRSA-N
Molecular Weight 252.266 g/mol
SMILES C=1([C@@]2(C(=O)C([C@@](C1)(C=C2)[H])(OC)OC)[H])C(=O)OCC
SPLASH splash10-0a4i-9400000000-8ef72c52b20f526ec73c
Source of Spectrum F5-4-2276-28aN
Wiley ID 1732824