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N-{4-[4-(methylsulfonyl)-2,6-dinitroanilino]phenyl}acetamide
SpectraBase Compound ID DKhQ8gYoaQ9
InChI InChI=1S/C15H14N4O7S/c1-9(20)16-10-3-5-11(6-4-10)17-15-13(18(21)22)7-12(27(2,25)26)8-14(15)19(23)24/h3-8,17H,1-2H3,(H,16,20)
InChIKey IKCPBWNVYQCLDJ-UHFFFAOYSA-N
Mol Weight 394.36 g/mol
Molecular Formula C15H14N4O7S
Exact Mass 394.05832 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID MvANhxrpEA
Name N-{4-[4-(methylsulfonyl)-2,6-dinitroanilino]phenyl}acetamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C15H14N4O7S/c1-9(20)16-10-3-5-11(6-4-10)17-15-13(18(21)22)7-12(27(2,25)26)8-14(15)19(23)24/h3-8,17H,1-2H3,(H,16,20)
InChIKey IKCPBWNVYQCLDJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12708
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 100939; Labnumber: REA14-0341; VK_ID: VK-012713
Temperature 315 °C