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Ethyl 2,4-diethyl-3,5-dioxo-1,2,4-triazolidine-1-carboxylate
SpectraBase Compound ID C8DqkhiExd6
InChI InChI=1S/C9H15N3O4/c1-4-10-7(13)11(5-2)12(8(10)14)9(15)16-6-3/h4-6H2,1-3H3
InChIKey PJYYTILGGMQLIG-UHFFFAOYSA-N
Mol Weight 229.24 g/mol
Molecular Formula C9H15N3O4
Exact Mass 229.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8C3ODmeUwlr
Name Ethyl 2,4-diethyl-3,5-dioxo-1,2,4-triazolidine-1-carboxylate
Alternate Name(s) 1,2,4-Triazolidine-1-carboxylic acid, 2,4-diethyl-3,5-dioxo-, ethyl ester 2,4-Diethyl-3,5-diketo-1,2,4-triazolidine-1-carboxylic acid ethyl ester 2,4-Diethyl-3,5-dioxo-1,2,4-triazolidine-1-carboxylic acid ethyl ester Ethyl 2,4-diethyl-3,5-bis(oxidanylidene)-1,2,4-triazolidine-1-carboxylate
CAS Registry Number 39636-04-9
Comments Edited after expert review for air contamination - Original record with SpectrumID 1230519 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15N3O4
InChI InChI=1S/C9H15N3O4/c1-4-10-7(13)11(5-2)12(8(10)14)9(15)16-6-3/h4-6H2,1-3H3
InChIKey PJYYTILGGMQLIG-UHFFFAOYSA-N
Molecular Weight 229.236 g/mol
SMILES CCN1C(N(CC)N(C1=O)C(=O)OCC)=O
SPLASH splash10-056u-8900000000-49f024e4cca7521d7164
Source of Spectrum W5-0-0-0
Wiley ID 1820982