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2-Allyl-2-but-2-ynyl-malonic acid diethyl ester
SpectraBase Compound ID Cl9S7prdzKH
InChI InChI=1S/C14H20O4/c1-5-9-11-14(10-6-2,12(15)17-7-3)13(16)18-8-4/h6H,2,7-8,10-11H2,1,3-4H3
InChIKey SGFYOGIBQCOXPJ-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoXvKUJ9z0W
Name 2-allyl-2-but-2-ynyl-malonic acid diethyl ester
Alternate Name(s) 2-but-2-ynyl-2-prop-2-enylpropanedioic acid diethyl ester diethyl 2-allyl-2-but-2-ynyl-propanedioate diethyl 2-but-2-ynyl-2-prop-2-enyl-propanedioate
CAS Registry Number 119548-53-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-5-9-11-14(10-6-2,12(15)17-7-3)13(16)18-8-4/h6H,2,7-8,10-11H2,1,3-4H3
InChIKey SGFYOGIBQCOXPJ-UHFFFAOYSA-N
Molecular Weight 252.310 g/mol
SMILES CC#CCC(CC=C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0006-0920000000-3c98033751cfdfcf21ae
Source of Spectrum QE-11-3878-0
Wiley ID 1638940