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Propanedioic acid, [[3-(2-propenyloxy)phenyl]methylene]-, diethyl ester
SpectraBase Compound ID BfLpaawOgSL
InChI InChI=1S/C17H20O5/c1-4-10-22-14-9-7-8-13(11-14)12-15(16(18)20-5-2)17(19)21-6-3/h4,7-9,11-12H,1,5-6,10H2,2-3H3
InChIKey WXAFTQKXJNTWHK-UHFFFAOYSA-N
Mol Weight 304.34 g/mol
Molecular Formula C17H20O5
Exact Mass 304.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ui9QssR6tl
Name Propanedioic acid, [[3-(2-propenyloxy)phenyl]methylene]-, diethyl ester
Alternate Name(s) diethyl 2-[3-(allyloxy)benzylidene]malonate Diethyl 3-allyloxybenzylidenemalonate
CAS Registry Number 99558-35-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O5
InChI InChI=1S/C17H20O5/c1-4-10-22-14-9-7-8-13(11-14)12-15(16(18)20-5-2)17(19)21-6-3/h4,7-9,11-12H,1,5-6,10H2,2-3H3
InChIKey WXAFTQKXJNTWHK-UHFFFAOYSA-N
Molecular Weight 304.342 g/mol
SMILES C(=Cc1cc(OCC=C)ccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0006-9003000000-bf6a45e5f03c43391341
Source of Spectrum KC-1985-1634-40
Wiley ID 1306457