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2,4-dichloro-N-[1-isobutyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide

View entire compound with spectra: 1 NMR

2,4-dichloro-N-[1-isobutyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
SpectraBase Compound ID IinjsP9iPWJ
InChI InChI=1S/C18H15Cl2F3N4O4/c1-7(2)6-27-12-11(14(29)25-16(27)31)17(15(30)24-12,18(21,22)23)26-13(28)9-4-3-8(19)5-10(9)20/h3-5,7H,6H2,1-2H3,(H,24,30)(H,26,28)(H,25,29,31)
InChIKey UDKXFDJVZAQUNR-UHFFFAOYSA-N
Mol Weight 479.24 g/mol
Molecular Formula C18H15Cl2F3N4O4
Exact Mass 478.042245 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2ALKmprb2V0
Name 2,4-dichloro-N-[1-isobutyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H15Cl2F3N4O4/c1-7(2)6-27-12-11(14(29)25-16(27)31)17(15(30)24-12,18(21,22)23)26-13(28)9-4-3-8(19)5-10(9)20/h3-5,7H,6H2,1-2H3,(H,24,30)(H,26,28)(H,25,29,31)
InChIKey UDKXFDJVZAQUNR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20330
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: D16538; Labnumber: SOK-1461; SBI_ID: SBI-020334
Temperature 318 °C