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MALONIC ACID, ETHYL-, DIETHYL ESTER

View entire compound with spectra: 10 NMR, 6 FTIR, 5 MS (GC), and 2 Near IR

MALONIC ACID, ETHYL-, DIETHYL ESTER
SpectraBase Compound ID ASWKvNGKAr8
InChI InChI=1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3
InChIKey VQAZCUCWHIIFGE-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2hp1He3oKw
Name Propanedioic acid, ethyl-, diethyl ester
Alternate Name(s) 2-Ethylmalonic acid diethyl ester 2-Ethylpropanedioic acid diethyl ester Diethyl 2-ethylmalonate Diethyl 2-ethylpropanedioate Diethyl ethylmalonate Ethyl diethylmalonate Ethylmalonic acid diethyl ester Malonic acid, ethyl-, diethyl ester AI3-19481 EINECS 205-093-3 NSC 8706
CAS Registry Number 133-13-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3
InChIKey VQAZCUCWHIIFGE-UHFFFAOYSA-N
Molecular Weight 188.223 g/mol
SMILES C(=O)(C(C(OCC)=O)CC)OCC
SPLASH splash10-0203-9500000000-7cbeca229f7d39883041
Wiley ID 1488325