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1,4-Diacetyl-5-(2,4-dichlorophenyl)-1,2,4-triazolidine-3-thione
SpectraBase Compound ID 8JXjKhVl38R
InChI InChI=1S/C12H11Cl2N3O2S/c1-6(18)16-11(17(7(2)19)15-12(16)20)9-4-3-8(13)5-10(9)14/h3-5,11H,1-2H3,(H,15,20)
InChIKey TXRCFENXWAOFRS-UHFFFAOYSA-N
Mol Weight 332.21 g/mol
Molecular Formula C12H11Cl2N3O2S
Exact Mass 330.994903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSH7WJQyEi4
Name 1,4-Diacetyl-5-(2,4-dichlorophenyl)-1,2,4-triazolidine-3-thione
Alternate Name(s) 1,2,4-Triazolidine-3-thione, 1,4-diacetyl-5-(2,4-dichlorophenyl)- 1-[1-acetyl-5-(2,4-dichlorophenyl)-3-sulfanylidene-1,2,4-triazolidin-4-yl]ethanone 1-[1-acetyl-5-(2,4-dichlorophenyl)-3-thioxo-1,2,4-triazolidin-4-yl]ethanone 1-[5-(2,4-dichlorophenyl)-1-ethanoyl-3-sulfanylidene-1,2,4-triazolidin-4-yl]ethanone
CAS Registry Number 299918-82-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11Cl2N3O2S
InChI InChI=1S/C12H11Cl2N3O2S/c1-6(18)16-11(17(7(2)19)15-12(16)20)9-4-3-8(13)5-10(9)14/h3-5,11H,1-2H3,(H,15,20)
InChIKey TXRCFENXWAOFRS-UHFFFAOYSA-N
Molecular Weight 332.205 g/mol
SMILES N1N(C(N(C1=S)C(=O)C)c1c(cc(cc1)Cl)Cl)C(=O)C
SPLASH splash10-0006-9420000000-4168fb4792c5c973f8e5
Source of Spectrum AD-0-2532-0
Wiley ID 1430541