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N-benzoyl-N-(phenylsulfonyl)-3-acetoxy-1,4-diamino-benzene
SpectraBase Compound ID FScQ8cY5zU7
InChI InChI=1S/C21H18N2O5S/c1-15(24)28-20-14-17(22)12-13-19(20)23(21(25)16-8-4-2-5-9-16)29(26,27)18-10-6-3-7-11-18/h2-14H,22H2,1H3
InChIKey VGALCPIPTXYMII-UHFFFAOYSA-N
Mol Weight 410.44 g/mol
Molecular Formula C21H18N2O5S
Exact Mass 410.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IheIQWJV2Qx
Name N-benzoyl-N-(phenylsulfonyl)-3-acetoxy-1,4-diamino-benzene
Alternate Name(s) 5-Amino-2-[benzoyl(phenylsulfonyl)amino]phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O5S
InChI InChI=1S/C21H18N2O5S/c1-15(24)28-20-14-17(22)12-13-19(20)23(21(25)16-8-4-2-5-9-16)29(26,27)18-10-6-3-7-11-18/h2-14H,22H2,1H3
InChIKey VGALCPIPTXYMII-UHFFFAOYSA-N
Molecular Weight 410.444 g/mol
SMILES Nc1ccc(N(S(=O)(=O)c2ccccc2)C(=O)c2ccccc2)c(OC(=O)C)c1
SPLASH splash10-0ab9-3900000000-62791f9f8762c4dde15d
Source of Spectrum J-55-1385-11
Wiley ID 1373566