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(5E)-1-sec-butyl-5-[(cyclopropylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

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(5E)-1-sec-butyl-5-[(cyclopropylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 47q5tyJZc14
InChI InChI=1S/C12H17N3O2S/c1-3-7(2)15-11(17)9(6-13-8-4-5-8)10(16)14-12(15)18/h6-8,13H,3-5H2,1-2H3,(H,14,16,18)/b9-6+
InChIKey BCOJNTZDBDDBLF-RMKNXTFCSA-N
Mol Weight 267.35 g/mol
Molecular Formula C12H17N3O2S
Exact Mass 267.104148 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A3l8xAgKe16
Name (5E)-1-sec-butyl-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/C12H17N3O2S/c1-3-7(2)15-11(17)9(6-13-8-4-5-8)10(16)14-12(15)18/h6-8,13H,3-5H2,1-2H3,(H,14,16,18)/b9-6+
InChIKey BCOJNTZDBDDBLF-RMKNXTFCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17650
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: D28866; Labnumber: KKA-0211-3831; SBI_ID: SBI-017653
Synonyms 1-sec-butyl-5-[(cyclopropylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 318 °C