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N-[2,4-Dibenzoyl-1-(3-chlorophenyl)pent-4-enyl]-4-methylbenzenesulfonamide
SpectraBase Compound ID BI652M2BPa8
InChI InChI=1S/C32H28ClNO4S/c1-22-16-18-28(19-17-22)39(37,38)34-30(26-14-9-15-27(33)21-26)29(32(36)25-12-7-4-8-13-25)20-23(2)31(35)24-10-5-3-6-11-24/h3-19,21,29-30,34H,2,20H2,1H3
InChIKey HWCVVZPCKJAGRM-UHFFFAOYSA-N
Mol Weight 558.1 g/mol
Molecular Formula C32H28ClNO4S
Exact Mass 557.142757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fmQBJr9qG1
Name N-[2,4-Dibenzoyl-1-(3-chlorophenyl)pent-4-enyl]-4-methylbenzenesulfonamide
Alternate Name(s) N-[2,4-dibenzoyl-1-(3-chlorophenyl)-4-pentenyl]-4-methylbenzenesulfonamide
Comments Less than 3 mono-isotopic peaks
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Formula C32H28ClNO4S
InChI InChI=1S/C32H28ClNO4S/c1-22-16-18-28(19-17-22)39(37,38)34-30(26-14-9-15-27(33)21-26)29(32(36)25-12-7-4-8-13-25)20-23(2)31(35)24-10-5-3-6-11-24/h3-19,21,29-30,34H,2,20H2,1H3
InChIKey HWCVVZPCKJAGRM-UHFFFAOYSA-N
Molecular Weight 558.092 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(CC(=C)C(c1ccccc1)=O)C(c1ccccc1)=O)c1cc(ccc1)Cl
SPLASH splash10-0a4i-0900400000-4b081b11fa09638a92ba
Source of Spectrum F-68-4789-2
Wiley ID 1572787