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1-[5-[(4-chlorobenzyl)thio]-4-nitro-2-thienyl]ethanone
SpectraBase Compound ID GoIoJEpukqo
InChI InChI=1S/C13H10ClNO3S2/c1-8(16)12-6-11(15(17)18)13(20-12)19-7-9-2-4-10(14)5-3-9/h2-6H,7H2,1H3
InChIKey RDTHPXUYMXYOOO-UHFFFAOYSA-N
Mol Weight 327.8 g/mol
Molecular Formula C13H10ClNO3S2
Exact Mass 326.979063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fakiHHi2Dz
Name 1-[5-[(4-chlorobenzyl)thio]-4-nitro-2-thienyl]ethanone
Alternate Name(s) 1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitro-2-thienyl]ethanone 1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitro-thiophen-2-yl]ethanone 1-[5-[(4-chlorophenyl)methylthio]-4-nitro-2-thiophenyl]ethanone
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Formula C13H10ClNO3S2
InChI InChI=1S/C13H10ClNO3S2/c1-8(16)12-6-11(15(17)18)13(20-12)19-7-9-2-4-10(14)5-3-9/h2-6H,7H2,1H3
InChIKey RDTHPXUYMXYOOO-UHFFFAOYSA-N
Molecular Weight 327.800 g/mol
SMILES c1(c(sc(c1)C(=O)C)SCc1ccc(cc1)Cl)N(=O)=O
SPLASH splash10-004i-0901000000-0626690beb988d69d49b
Source of Spectrum Y-35-1524-4
Wiley ID 1325348