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Diethyl 2,2'-[(1,3-dimethyl-4,6-dioxo-2-thioxohexahydropyrimidine-5,5-diyl)]bis{3-[(anilinocarbonyl)hydrazono]butanoate}
SpectraBase Compound ID KJ3Bps1x8yZ
InChI InChI=1S/C20H30N8O9/c1-7-36-13(29)11(9(3)23-25-17(21)33)20(15(31)27(5)19(35)28(6)16(20)32)12(14(30)37-8-2)10(4)24-26-18(22)34/h11-12H,7-8H2,1-6H3,(H3,21,25,33)(H3,22,26,34)
InChIKey UHGYAQXKCXQBRU-UHFFFAOYSA-N
Mol Weight 526.51 g/mol
Molecular Formula C20H30N8O9
Exact Mass 526.213575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DG9Dh3b2yRI
Name Diethyl 2,2'-[(1,3-dimethyl-4,6-dioxo-2-thioxohexahydropyrimidine-5,5-diyl)]bis{3-[(anilinocarbonyl)hydrazono]butanoate}
Alternate Name(s) Diethyl 2,2'-(1,3-dimethyl-2,4,6-trioxohexahydropyrimidine-5,5-diyl)bis(3-(2-carbamoylhydrazineylidene)butanoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30N8O9
InChI InChI=1S/C20H30N8O9/c1-7-36-13(29)11(9(3)23-25-17(21)33)20(15(31)27(5)19(35)28(6)16(20)32)12(14(30)37-8-2)10(4)24-26-18(22)34/h11-12H,7-8H2,1-6H3,(H3,21,25,33)(H3,22,26,34)
InChIKey UHGYAQXKCXQBRU-UHFFFAOYSA-N
Molecular Weight 526.507 g/mol
SMILES N(N=C(C(C1(C(C(=NNC(=O)N)C)C(=O)OCC)C(N(C(N(C1=O)C)=O)C)=O)C(=O)OCC)C)C(=O)N
SPLASH splash10-0002-0910000000-4b5cb4815bcbf285b47a
Source of Spectrum F-71-7286-3f
Wiley ID 1803109