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(5E)-5-({[3-(dimethylamino)propyl]amino}methylene)-1-isopropyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID Bbzv6R9pDyv
InChI InChI=1S/C13H22N4O2S/c1-9(2)17-12(19)10(11(18)15-13(17)20)8-14-6-5-7-16(3)4/h8-9,14H,5-7H2,1-4H3,(H,15,18,20)/b10-8+
InChIKey VXJPJSGXTPNMQA-CSKARUKUSA-N
Mol Weight 298.4 g/mol
Molecular Formula C13H22N4O2S
Exact Mass 298.146347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HYlgM9aIV6Y
Name (5E)-5-({[3-(dimethylamino)propyl]amino}methylene)-1-isopropyl-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/C13H22N4O2S/c1-9(2)17-12(19)10(11(18)15-13(17)20)8-14-6-5-7-16(3)4/h8-9,14H,5-7H2,1-4H3,(H,15,18,20)/b10-8+
InChIKey VXJPJSGXTPNMQA-CSKARUKUSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22257
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: D58406; Labnumber: KV-2440; SBI_ID: SBI-022261
Synonyms 5-({[3-(dimethylamino)propyl]amino}methylene)-1-isopropyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 306 °C