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3-(2-Hydroxy-3-methylsulfanlpropyl)-5-(4-bromobenzoyl)methylsulfanyl-2,3-dihydro-1,3,4-thiadiazole-2-thione
SpectraBase Compound ID LKxD4kErUOj
InChI InChI=1S/C14H15BrN2O2S4/c1-8(20)11(18)6-17-14(21)23-13(16-17)22-7-12(19)9-2-4-10(15)5-3-9/h2-5,8,11,18,20H,6-7H2,1H3
InChIKey LHFNCBNYZPEETK-UHFFFAOYSA-N
Mol Weight 451.4 g/mol
Molecular Formula C14H15BrN2O2S4
Exact Mass 449.919975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HNvePPBBUcZ
Name 3-(2-Hydroxy-3-methylsulfanlpropyl)-5-(4-bromobenzoyl)methylsulfanyl-2,3-dihydro-1,3,4-thiadiazole-2-thione
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Formula C14H15BrN2O2S4
InChI InChI=1S/C14H15BrN2O2S4/c1-8(20)11(18)6-17-14(21)23-13(16-17)22-7-12(19)9-2-4-10(15)5-3-9/h2-5,8,11,18,20H,6-7H2,1H3
InChIKey LHFNCBNYZPEETK-UHFFFAOYSA-N
Molecular Weight 451.430 g/mol
SMILES SC(C(CN1C(SC(=N1)SCC(c1ccc(cc1)Br)=O)=S)O)C
SPLASH splash10-0f7k-0809500000-1818251550a0977af3f4
Source of Spectrum CV-2004-1260-9
Wiley ID 1611453