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Diethyl 2-(4-chlorobenzyl)-2-(4-(methoxycarbonyloxy)but-2-enyl)malonate
SpectraBase Compound ID L56M8d6cKeQ
InChI InChI=1S/C20H25ClO7/c1-4-26-17(22)20(18(23)27-5-2,12-6-7-13-28-19(24)25-3)14-15-8-10-16(21)11-9-15/h6-11H,4-5,12-14H2,1-3H3/b7-6-
InChIKey YTUJJRHYZNZCIJ-SREVYHEPSA-N
Mol Weight 412.87 g/mol
Molecular Formula C20H25ClO7
Exact Mass 412.128881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EykJFzbe0od
Name Diethyl 2-(4-chlorobenzyl)-2-(4-(methoxycarbonyloxy)but-2-enyl)malonate
Alternate Name(s) (Z)-diethyl 2-(4-chlorobenzyl)-2-(4-((methoxycarbonyl)oxy)but-2-en-1-yl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25ClO7
InChI InChI=1S/C20H25ClO7/c1-4-26-17(22)20(18(23)27-5-2,12-6-7-13-28-19(24)25-3)14-15-8-10-16(21)11-9-15/h6-11H,4-5,12-14H2,1-3H3/b7-6-
InChIKey YTUJJRHYZNZCIJ-SREVYHEPSA-N
Literature Reference DOI 10.1002/adsc.200700607
Molecular Weight 412.866 g/mol
SMILES c1cc(CC(C(OCC)=O)(C\C=C/COC(OC)=O)C(OCC)=O)ccc1Cl
SPLASH splash10-004i-0940000000-5c3d153be322bafdd4f6
Source of Spectrum ASC-350-531/SM5-3m
Wiley ID 1766065