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3,5-dinitro-N-[2,2,2-trichloro-1-(4-toluidino)ethyl]benzamide
SpectraBase Compound ID JJxLc2sxEnU
InChI InChI=1S/C16H13Cl3N4O5/c1-9-2-4-11(5-3-9)20-15(16(17,18)19)21-14(24)10-6-12(22(25)26)8-13(7-10)23(27)28/h2-8,15,20H,1H3,(H,21,24)
InChIKey FVCHKKHTNTUSBP-UHFFFAOYSA-N
Mol Weight 447.66 g/mol
Molecular Formula C16H13Cl3N4O5
Exact Mass 445.995153 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID VrsNMEliJX
Name 3,5-dinitro-N-[2,2,2-trichloro-1-(4-toluidino)ethyl]benzamide
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/C16H13Cl3N4O5/c1-9-2-4-11(5-3-9)20-15(16(17,18)19)21-14(24)10-6-12(22(25)26)8-13(7-10)23(27)28/h2-8,15,20H,1H3,(H,21,24)
InChIKey FVCHKKHTNTUSBP-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_989
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: 700011EX00006816; Labnumber: 700011EX00006816; VK_ID: VK-000990
Temperature 313 °C