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(4-bromophenyl)-(4-tosylpiperazino)methanone
SpectraBase Compound ID DUrTBnM5whj
InChI InChI=1S/C18H19BrN2O3S/c1-14-2-8-17(9-3-14)25(23,24)21-12-10-20(11-13-21)18(22)15-4-6-16(19)7-5-15/h2-9H,10-13H2,1H3
InChIKey VFPVRNMPJGKRGV-UHFFFAOYSA-N
Mol Weight 423.33 g/mol
Molecular Formula C18H19BrN2O3S
Exact Mass 422.029977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Hoq2wCNRQ
Name (4-bromophenyl)-(4-tosylpiperazino)methanone
Alternate Name(s) (4-bromophenyl)-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone (4-bromophenyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone (4-bromophenyl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone
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Formula C18H19BrN2O3S
InChI InChI=1S/C18H19BrN2O3S/c1-14-2-8-17(9-3-14)25(23,24)21-12-10-20(11-13-21)18(22)15-4-6-16(19)7-5-15/h2-9H,10-13H2,1H3
InChIKey VFPVRNMPJGKRGV-UHFFFAOYSA-N
Molecular Weight 423.325 g/mol
SMILES Cc1ccc(S(N2CCN(C(c3ccc(cc3)Br)=O)CC2)(=O)=O)cc1
SPLASH splash10-014i-7960000000-f307aeaf88071bca5268
Wiley ID 1442941