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Ethyl 5,5-dimethyl-2-ethyl-3,4-dioxohept-6-enoate
SpectraBase Compound ID LvCS474JDyk
InChI InChI=1S/C13H20O4/c1-6-9(12(16)17-8-3)10(14)11(15)13(4,5)7-2/h7,9H,2,6,8H2,1,3-5H3
InChIKey MHZNHZGAXMLWAI-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gx6NMRFt37T
Name Ethyl 5,5-dimethyl-2-ethyl-3,4-dioxohept-6-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-6-9(12(16)17-8-3)10(14)11(15)13(4,5)7-2/h7,9H,2,6,8H2,1,3-5H3
InChIKey MHZNHZGAXMLWAI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201201724
Molecular Weight 240.299 g/mol
SMILES CC(C)(C(C(=O)C(CC)C(=O)OCC)=O)C=C
SPLASH splash10-014m-9600000000-3089fa6792770ecf1ff9
Source of Spectrum ACI-51-SMS38-24
Synonyms Ethyl 2-ethyl-5,5-dimethyl-3,4-dioxohept-6-enoate
Wiley ID 1780303