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Benzenecarboximidamide, N-(4-methylphenyl)-N'-[2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-
SpectraBase Compound ID IOBU10Sm6GL
InChI InChI=1S/C27H24N2O3S/c1-20-12-16-23(17-13-20)28-27(22-8-4-3-5-9-22)29-25-10-6-7-11-26(25)32-33(30,31)24-18-14-21(2)15-19-24/h3-19H,1-2H3,(H,28,29)
InChIKey ZPRQYVAXGIDONT-UHFFFAOYSA-N
Mol Weight 456.56 g/mol
Molecular Formula C27H24N2O3S
Exact Mass 456.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKtWkAsdxa2
Name Benzenecarboximidamide, N-(4-methylphenyl)-N'-[2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-
CAS Registry Number 86317-95-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O3S
InChI InChI=1S/C27H24N2O3S/c1-20-12-16-23(17-13-20)28-27(22-8-4-3-5-9-22)29-25-10-6-7-11-26(25)32-33(30,31)24-18-14-21(2)15-19-24/h3-19H,1-2H3,(H,28,29)
InChIKey ZPRQYVAXGIDONT-UHFFFAOYSA-N
Molecular Weight 456.560 g/mol
SMILES N(\C(=N\c1c(OS(c2ccc(cc2)C)(=O)=O)cccc1)c1ccccc1)c1ccc(cc1)C
SPLASH splash10-0a4i-1902100000-9ba089a2a7bb805fde17
Source of Spectrum K-116-1829-0
Synonyms 2-{[(E)-phenyl(4-toluidino)methylidene]amino}phenyl 4-methylbenzenesulfonate N-(4-methylphenyl)-N'-[2-(4-methylphenylsulfonyloxy)phenyl]benzamidine
Wiley ID 1389354