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3-Acetamido-1,4-diacetyl-5-( 2'-thienenyl)-4,5-dihydro-1H-1,2,4-triazole
SpectraBase Compound ID HfHA7nMsGac
InChI InChI=1S/C12H14N4O3S/c1-7(17)13-12-14-16(9(3)19)11(15(12)8(2)18)10-4-5-20-6-10/h4-6,11H,1-3H3,(H,13,14,17)
InChIKey NUPCNCHVXPXCQH-UHFFFAOYSA-N
Mol Weight 294.33 g/mol
Molecular Formula C12H14N4O3S
Exact Mass 294.078661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bvvf84Oar0n
Name 3-Acetamido-1,4-diacetyl-5-( 2'-thienenyl)-4,5-dihydro-1H-1,2,4-triazole
Alternate Name(s) N-[1,4-diacetyl-5-(3-thienyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]acetamide
Comments Less than 3 mono-isotopic peaks
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Formula C12H14N4O3S
InChI InChI=1S/C12H14N4O3S/c1-7(17)13-12-14-16(9(3)19)11(15(12)8(2)18)10-4-5-20-6-10/h4-6,11H,1-3H3,(H,13,14,17)
InChIKey NUPCNCHVXPXCQH-UHFFFAOYSA-N
Molecular Weight 294.329 g/mol
SMILES N(C1=NN(C(N1C(=O)C)c1cscc1)C(=O)C)C(=O)C
SPLASH splash10-0006-9000000000-9e916160b0511cc13225
Source of Spectrum AH-126-743-2
Wiley ID 1296760