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Propanethioamide, 2-[(2,4-dinitrophenyl)amino]-N,N,2-trimethyl-
SpectraBase Compound ID ADhywg9AAiA
InChI InChI=1S/C12H16N4O4S/c1-12(2,11(21)14(3)4)13-9-6-5-8(15(17)18)7-10(9)16(19)20/h5-7,13H,1-4H3
InChIKey SFECIOJGURVGGR-UHFFFAOYSA-N
Mol Weight 312.34 g/mol
Molecular Formula C12H16N4O4S
Exact Mass 312.089226 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkPr8pgf9As
Name Propanethioamide, 2-[(2,4-dinitrophenyl)amino]-N,N,2-trimethyl-
CAS Registry Number 65062-50-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N4O4S
InChI InChI=1S/C12H16N4O4S/c1-12(2,11(21)14(3)4)13-9-6-5-8(15(17)18)7-10(9)16(19)20/h5-7,13H,1-4H3
InChIKey SFECIOJGURVGGR-UHFFFAOYSA-N
Molecular Weight 312.344 g/mol
SMILES N(C(C(=S)N(C)C)(C)C)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-00dr-6190000000-066f58733d8247dc7093
Source of Spectrum H-60-2283-0
Synonyms 2-(2,4-dinitroanilino)-N,N,2-trimethylpropanethioamide 2-(N'-(2,4-dinitrophenyl)amino)-N,N-dimethylisobutyrothioamide
Wiley ID 1312868