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

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N-[1-(2-furylmethyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbutanamide
SpectraBase Compound ID 4cIZFSilo2H
InChI InChI=1S/C17H17F3N4O5/c1-8(2)6-10(25)23-16(17(18,19)20)11-12(21-14(16)27)24(15(28)22-13(11)26)7-9-4-3-5-29-9/h3-5,8H,6-7H2,1-2H3,(H,21,27)(H,23,25)(H,22,26,28)
InChIKey ZONZMWUTIHTMHG-UHFFFAOYSA-N
Mol Weight 414.34 g/mol
Molecular Formula C17H17F3N4O5
Exact Mass 414.115104 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HbNrBg1WyNs
Name N-[1-(2-furylmethyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbutanamide
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/C17H17F3N4O5/c1-8(2)6-10(25)23-16(17(18,19)20)11-12(21-14(16)27)24(15(28)22-13(11)26)7-9-4-3-5-29-9/h3-5,8H,6-7H2,1-2H3,(H,21,27)(H,23,25)(H,22,26,28)
InChIKey ZONZMWUTIHTMHG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20839
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: D50007; Labnumber: SOK-1895; SBI_ID: SBI-020843
Temperature 315 °C