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N-( 4'-Chlorophenyl)-6-nitro-1,4-thia-1,2,3,4-tetrahydronaphthalene-2,3-dicarbonyl-imide
SpectraBase Compound ID BZSB9SyJara
InChI InChI=1S/C18H11ClN2O4S/c19-8-1-3-9(4-2-8)20-17(22)13-14(18(20)23)16-12-7-10(21(24)25)5-6-11(12)15(13)26-16/h1-7,13-16H
InChIKey RSGQDINPINBQJI-UHFFFAOYSA-N
Mol Weight 386.81 g/mol
Molecular Formula C18H11ClN2O4S
Exact Mass 386.012806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KJf0CbKQxY
Name N-( 4'-Chlorophenyl)-6-nitro-1,4-thia-1,2,3,4-tetrahydronaphthalene-2,3-dicarbonyl-imide
Alternate Name(s) 11-(4-chlorophenyl)-4-nitro-14-thia-11-azatetracyclo[6.5.1.0(2,7).0(9,13)]tetradeca-2,4,6-triene-10,12-dione
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Formula C18H11ClN2O4S
InChI InChI=1S/C18H11ClN2O4S/c19-8-1-3-9(4-2-8)20-17(22)13-14(18(20)23)16-12-7-10(21(24)25)5-6-11(12)15(13)26-16/h1-7,13-16H
InChIKey RSGQDINPINBQJI-UHFFFAOYSA-N
Molecular Weight 386.809 g/mol
SMILES C12C(C(=O)N(C2=O)c2ccc(cc2)Cl)C2SC1c1c2ccc(N(=O)=O)c1
SPLASH splash10-004i-0902000000-e948348a3c2097db2ec5
Source of Spectrum AH-128-278-6
Wiley ID 1362455