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(5E)-1-allyl-5-[1-(2,3-dihydro-1H-inden-5-ylamino)propylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 3FBilkb960y
InChI InChI=1S/C19H21N3O3/c1-3-10-22-18(24)16(17(23)21-19(22)25)15(4-2)20-14-9-8-12-6-5-7-13(12)11-14/h3,8-9,11,20H,1,4-7,10H2,2H3,(H,21,23,25)/b16-15+
InChIKey XNWRTAKKTWWWJB-FOCLMDBBSA-N
Mol Weight 339.4 g/mol
Molecular Formula C19H21N3O3
Exact Mass 339.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5AvAdqlH22N
Name (5E)-1-allyl-5-[1-(2,3-dihydro-1H-inden-5-ylamino)propylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C19H21N3O3/c1-3-10-22-18(24)16(17(23)21-19(22)25)15(4-2)20-14-9-8-12-6-5-7-13(12)11-14/h3,8-9,11,20H,1,4-7,10H2,2H3,(H,21,23,25)/b16-15+
InChIKey XNWRTAKKTWWWJB-FOCLMDBBSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13549
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: D86188; Labnumber: KKA-0212A-0879; SBI_ID: SBI-013552
Synonyms 1-allyl-5-[1-(2,3-dihydro-1H-inden-5-ylamino)propylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C