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(5Z)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID LvoDFRTmv9m
InChI InChI=1S/C18H21N3O2S/c1-20-10-5-8-14(20)12-15-16(22)19-18(24)21(17(15)23)11-9-13-6-3-2-4-7-13/h5-6,8,10,12H,2-4,7,9,11H2,1H3,(H,19,22,24)/b15-12-
InChIKey WYYILZVUZCMEFB-QINSGFPZSA-N
Mol Weight 343.45 g/mol
Molecular Formula C18H21N3O2S
Exact Mass 343.135448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9R3KyzaHX0q
Name (5Z)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C18H21N3O2S/c1-20-10-5-8-14(20)12-15-16(22)19-18(24)21(17(15)23)11-9-13-6-3-2-4-7-13/h5-6,8,10,12H,2-4,7,9,11H2,1H3,(H,19,22,24)/b15-12-
InChIKey WYYILZVUZCMEFB-QINSGFPZSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12199
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 803328; Labnumber: NC98SP32-484; VK_ID: VK-012204
Synonyms 1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 313 °C