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2-propynyl N-benzoyl-N'-[(Z)-oxo(phenyl)methyl]imidothiocarbamate
SpectraBase Compound ID 6jq0iwXqI09
InChI InChI=1S/C18H14N2O2S/c1-2-13-23-18(19-16(21)14-9-5-3-6-10-14)20-17(22)15-11-7-4-8-12-15/h1,3-12H,13H2,(H,19,20,21,22)
InChIKey NLWRUZNCKYKMBY-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C18H14N2O2S
Exact Mass 322.077599 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8AD4OyhmNeu
Name 2-propynyl N-benzoyl-N'-[(Z)-oxo(phenyl)methyl]imidothiocarbamate
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/C18H14N2O2S/c1-2-13-23-18(19-16(21)14-9-5-3-6-10-14)20-17(22)15-11-7-4-8-12-15/h1,3-12H,13H2,(H,19,20,21,22)
InChIKey NLWRUZNCKYKMBY-UHFFFAOYSA-N
NMR Offset 15.3255
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12847
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: 101371; Labnumber: RRUL-072; VK_ID: VK-012852
Synonyms 2-propynyl N-benzoyl-N'-[oxo(phenyl)methyl]imidothiocarbamate
Temperature 318 °C