2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[4-(4-fluorophenoxy)phenyl]acetamide

SpectraBase Compound ID	FsU9zm4zNVU
InChI	InChI=1S/C21H18FN5O4/c1-25-19-18(20(29)26(2)21(25)30)27(12-23-19)11-17(28)24-14-5-9-16(10-6-14)31-15-7-3-13(22)4-8-15/h3-10,12H,11H2,1-2H3,(H,24,28)
InChIKey	SXSCQJCZTSRVAM-UHFFFAOYSA-N Google Search
Mol Weight	423.4 g/mol
Molecular Formula	C21H18FN5O4
Exact Mass	423.134282 g/mol

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SpectraBase Spectrum ID	8sXfznHHsO2
Name	2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[4-(4-fluorophenoxy)phenyl]acetamide
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/C21H18FN5O4/c1-25-19-18(20(29)26(2)21(25)30)27(12-23-19)11-17(28)24-14-5-9-16(10-6-14)31-15-7-3-13(22)4-8-15/h3-10,12H,11H2,1-2H3,(H,24,28)
InChIKey	SXSCQJCZTSRVAM-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6123
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: NMR/11242351; Labnumber: SAD-0003002; IOH_ID: IOH-006124