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N-(4-{[(E)-(1-cycloheptyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
SpectraBase Compound ID 9OVTyY36e85
InChI InChI=1S/C20H24N4O4/c1-13(25)22-15-10-8-14(9-11-15)21-12-17-18(26)23-20(28)24(19(17)27)16-6-4-2-3-5-7-16/h8-12,16,21H,2-7H2,1H3,(H,22,25)(H,23,26,28)/b17-12+
InChIKey PQARNAAXDQNNOG-SFQUDFHCSA-N
Mol Weight 384.44 g/mol
Molecular Formula C20H24N4O4
Exact Mass 384.179755 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1fHfl6vkdht
Name N-(4-{[(E)-(1-cycloheptyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
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/C20H24N4O4/c1-13(25)22-15-10-8-14(9-11-15)21-12-17-18(26)23-20(28)24(19(17)27)16-6-4-2-3-5-7-16/h8-12,16,21H,2-7H2,1H3,(H,22,25)(H,23,26,28)/b17-12+
InChIKey PQARNAAXDQNNOG-SFQUDFHCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13514
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: D86120; Labnumber: KKA-0211-3661; SBI_ID: SBI-013517
Synonyms N-(4-{[(1-cycloheptyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
Temperature 318 °C