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(5E)-5-[(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID GdeJMRkNmdw
InChI InChI=1S/C21H23N3O4/c1-13-10-15(14(2)24(13)16-6-3-4-7-16)11-18-19(25)22-21(27)23(20(18)26)12-17-8-5-9-28-17/h5,8-11,16H,3-4,6-7,12H2,1-2H3,(H,22,25,27)/b18-11+
InChIKey ZRYRCVXDJUYJPL-WOJGMQOQSA-N
Mol Weight 381.43 g/mol
Molecular Formula C21H23N3O4
Exact Mass 381.168856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 173FqkNu98T
Name (5E)-5-[(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(2-furylmethyl)-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/C21H23N3O4/c1-13-10-15(14(2)24(13)16-6-3-4-7-16)11-18-19(25)22-21(27)23(20(18)26)12-17-8-5-9-28-17/h5,8-11,16H,3-4,6-7,12H2,1-2H3,(H,22,25,27)/b18-11+
InChIKey ZRYRCVXDJUYJPL-WOJGMQOQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15687
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: C75060; Labnumber: SPDEM-1778; SBI_ID: SBI-015690
Synonyms 5-[(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C