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Cyclohexanamine, N-(4-nitrobenzoyl)-2-(phenylsulfonylmethylene)-

View entire compound with spectra: 2 MS (GC)

Cyclohexanamine, N-(4-nitrobenzoyl)-2-(phenylsulfonylmethylene)-
SpectraBase Compound ID 76oEsNOEgB0
InChI InChI=1S/C20H20N2O5S/c23-20(15-10-12-17(13-11-15)22(24)25)21-19-9-5-4-6-16(19)14-28(26,27)18-7-2-1-3-8-18/h1-3,7-8,10-14,19H,4-6,9H2,(H,21,23)/b16-14+
InChIKey UZGUGBZUEWECQT-JQIJEIRASA-N
Mol Weight 400.45 g/mol
Molecular Formula C20H20N2O5S
Exact Mass 400.109293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OOftPG2Lbr
Name
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Formula C20H20N2O5S
InChI InChI=1S/C20H20N2O5S/c23-20(15-10-12-17(13-11-15)22(24)25)21-19-9-5-4-6-16(19)14-28(26,27)18-7-2-1-3-8-18/h1-3,7-8,10-14,19H,4-6,9H2,(H,21,23)/b16-14+
InChIKey UZGUGBZUEWECQT-JQIJEIRASA-N
Molecular Weight 400.1088
SMILES N(C(c1ccc(N(=O)=O)cc1)=O)C1\C(=C\S(c2ccccc2)(=O)=O)CCCC1
SPLASH splash10-0zfr-9870000000-c119b2a106530483dae0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany