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(5Z)-1-allyl-5-[(cyclopropylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 4WTW4zj0XC6
InChI InChI=1S/C11H13N3O2S/c1-2-5-14-10(16)8(6-12-7-3-4-7)9(15)13-11(14)17/h2,6-7,12H,1,3-5H2,(H,13,15,17)/b8-6-
InChIKey ZWRWWYWBGMRTPH-VURMDHGXSA-N
Mol Weight 251.3 g/mol
Molecular Formula C11H13N3O2S
Exact Mass 251.072848 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID APWMq8OAzi9
Name (5Z)-1-allyl-5-[(cyclopropylamino)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/C11H13N3O2S/c1-2-5-14-10(16)8(6-12-7-3-4-7)9(15)13-11(14)17/h2,6-7,12H,1,3-5H2,(H,13,15,17)/b8-6-
InChIKey ZWRWWYWBGMRTPH-VURMDHGXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17600
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: D28739; Labnumber: KKA-0211-2343; SBI_ID: SBI-017603
Synonyms 1-allyl-5-[(cyclopropylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C