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Diethyl-dithiocarbamic acid (4-fluoro-phenylcarbamoyl)-methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Diethyl-dithiocarbamic acid (4-fluoro-phenylcarbamoyl)-methyl ester
SpectraBase Compound ID BeIwpKeqzIe
InChI InChI=1S/C13H17FN2OS2/c1-3-16(4-2)13(18)19-9-12(17)15-11-7-5-10(14)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,15,17)
InChIKey PKHQFPYSNCJYOJ-UHFFFAOYSA-N
Mol Weight 300.41 g/mol
Molecular Formula C13H17FN2OS2
Exact Mass 300.076634 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3QrJQKcHsDb
Name carbamodithioic acid, diethyl-, 2-[(4-fluorophenyl)amino]-2-oxoethyl ester
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/C13H17FN2OS2/c1-3-16(4-2)13(18)19-9-12(17)15-11-7-5-10(14)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,15,17)
InChIKey PKHQFPYSNCJYOJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_649
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: NMR/8241613; Labnumber: LP-2180551
Temperature 303 °C