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Ethyl 2-[(acetonyl)thiocarbonyl]amino-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID LDGc3P9EMQJ
InChI InChI=1S/C13H17NO3S2/c1-5-17-13(16)11-8(3)9(4)19-12(11)14-10(18)6-7(2)15/h5-6H2,1-4H3,(H,14,18)
InChIKey IJUXNYJPXDYQEC-UHFFFAOYSA-N
Mol Weight 299.4 g/mol
Molecular Formula C13H17NO3S2
Exact Mass 299.064986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hhtx0E1g7pV
Name Ethyl 2-[(acetonyl)thiocarbonyl]amino-4,5-dimethyl-3-thiophenecarboxylate
Alternate Name(s) Ethyl 4,5-dimethyl-2-[(3-oxobutanethioyl)amino]-3-thiophenecarboxylate
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Formula C13H17NO3S2
InChI InChI=1S/C13H17NO3S2/c1-5-17-13(16)11-8(3)9(4)19-12(11)14-10(18)6-7(2)15/h5-6H2,1-4H3,(H,14,18)
InChIKey IJUXNYJPXDYQEC-UHFFFAOYSA-N
Molecular Weight 299.403 g/mol
SMILES N(c1c(c(c(s1)C)C)C(=O)OCC)C(=S)CC(=O)C
SPLASH splash10-0udj-0791000000-8812665290855dd8971b
Source of Spectrum U-1995-447-4
Wiley ID 766661