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2,2-dimethyl-N-(2,2,2-trichloro-1-{[(3-nitroanilino)carbothioyl]amino}ethyl)propanamide
SpectraBase Compound ID 8JA7vqFtcgH
InChI InChI=1S/C14H17Cl3N4O3S/c1-13(2,3)11(22)19-10(14(15,16)17)20-12(25)18-8-5-4-6-9(7-8)21(23)24/h4-7,10H,1-3H3,(H,19,22)(H2,18,20,25)
InChIKey FCQNSHNBKDVOFL-UHFFFAOYSA-N
Mol Weight 427.73 g/mol
Molecular Formula C14H17Cl3N4O3S
Exact Mass 426.008695 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4X9TW0KzJy
Name 2,2-dimethyl-N-(2,2,2-trichloro-1-{[(3-nitroanilino)carbothioyl]amino}ethyl)propanamide
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/C14H17Cl3N4O3S/c1-13(2,3)11(22)19-10(14(15,16)17)20-12(25)18-8-5-4-6-9(7-8)21(23)24/h4-7,10H,1-3H3,(H,19,22)(H2,18,20,25)
InChIKey FCQNSHNBKDVOFL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16013
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: 987/00003023; Labnumber: 987/00003023218836; VK_ID: VK-016018
Temperature 308 °C