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(5Z)-5-[(cyclopropylamino)methylene]-1-(3-methoxyphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID Ih85ZGbmsvh
InChI InChI=1S/C15H15N3O3S/c1-21-11-4-2-3-10(7-11)18-14(20)12(8-16-9-5-6-9)13(19)17-15(18)22/h2-4,7-9,16H,5-6H2,1H3,(H,17,19,22)/b12-8-
InChIKey VRWXMAANFFDEQE-WQLSENKSSA-N
Mol Weight 317.36 g/mol
Molecular Formula C15H15N3O3S
Exact Mass 317.083413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2VaTxoi1Mr8
Name (5Z)-5-[(cyclopropylamino)methylene]-1-(3-methoxyphenyl)-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/C15H15N3O3S/c1-21-11-4-2-3-10(7-11)18-14(20)12(8-16-9-5-6-9)13(19)17-15(18)22/h2-4,7-9,16H,5-6H2,1H3,(H,17,19,22)/b12-8-
InChIKey VRWXMAANFFDEQE-WQLSENKSSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17628
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: D28820; Labnumber: KKA-0211-2963; SBI_ID: SBI-017631
Synonyms 5-[(cyclopropylamino)methylene]-1-(3-methoxyphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 318 °C