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Benzenecarboximidamide, N-[2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-N'-(4-nitrophenyl)-
SpectraBase Compound ID A6anxEGszt
InChI InChI=1S/C26H21N3O5S/c1-19-11-17-23(18-12-19)35(32,33)34-25-10-6-5-9-24(25)28-26(20-7-3-2-4-8-20)27-21-13-15-22(16-14-21)29(30)31/h2-18H,1H3,(H,27,28)
InChIKey DGWKGHNXJOTGIE-UHFFFAOYSA-N
Mol Weight 487.53 g/mol
Molecular Formula C26H21N3O5S
Exact Mass 487.120192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xWQDLnEGGO
Name Benzenecarboximidamide, N-[2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-N'-(4-nitrophenyl)-
Alternate Name(s) 2-{[(E)-(4-nitroanilino)(phenyl)methylidene]amino}phenyl 4-methylbenzenesulfonate N-[2-(4-methylphenylsulfonyloxy)phenyl]-N'-(4-nitrophenyl)benzamidine
CAS Registry Number 86317-96-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21N3O5S
InChI InChI=1S/C26H21N3O5S/c1-19-11-17-23(18-12-19)35(32,33)34-25-10-6-5-9-24(25)28-26(20-7-3-2-4-8-20)27-21-13-15-22(16-14-21)29(30)31/h2-18H,1H3,(H,27,28)
InChIKey DGWKGHNXJOTGIE-UHFFFAOYSA-N
Molecular Weight 487.530 g/mol
SMILES N(\C(=N\c1c(OS(c2ccc(cc2)C)(=O)=O)cccc1)c1ccccc1)c1ccc(N(=O)=O)cc1
SPLASH splash10-00os-2937200000-ee2ae988bae6be328819
Source of Spectrum K-116-1829-0
Wiley ID 1396694