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Diethyl 2-allyl-2-(2-oxopropyl)malonate
SpectraBase Compound ID 9460eK7gfh8
InChI InChI=1S/C13H20O5/c1-5-8-13(9-10(4)14,11(15)17-6-2)12(16)18-7-3/h5H,1,6-9H2,2-4H3
InChIKey RPHNXHQGWWMYSG-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C13H20O5
Exact Mass 256.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3wHVnJsaqu
Name Diethyl 2-allyl-2-(2-oxopropyl)malonate
Appearance Colorless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O5
GC Oven Program Oven temp 310 oC
InChI InChI=1S/C13H20O5/c1-5-8-13(9-10(4)14,11(15)17-6-2)12(16)18-7-3/h5H,1,6-9H2,2-4H3
InChIKey RPHNXHQGWWMYSG-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.202112101
Molecular Weight 256.298 g/mol
Quality 679
SMILES C(C(CC(=O)C)(C(OCC)=O)C(=O)OCC)C=C
SPLASH splash10-0ugi-8900000000-7e22ae130dd3b8522d46
Source of Spectrum ACI-61-SM63-S1 (DOI: 10.1002/anie.202112101)
Wiley ID 1897698