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2-[(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
SpectraBase Compound ID 4t1HuPifZP7
InChI InChI=1S/C18H21N5O4S/c1-5-23-14-15(21(2)18(26)22(3)16(14)25)20-17(23)28-10-13(24)19-11-8-6-7-9-12(11)27-4/h6-9H,5,10H2,1-4H3,(H,19,24)
InChIKey PULAIMIPUZMHIJ-UHFFFAOYSA-N
Mol Weight 403.46 g/mol
Molecular Formula C18H21N5O4S
Exact Mass 403.131425 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CoHeSB8vDbk
Name 2-[(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)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/C18H21N5O4S/c1-5-23-14-15(21(2)18(26)22(3)16(14)25)20-17(23)28-10-13(24)19-11-8-6-7-9-12(11)27-4/h6-9H,5,10H2,1-4H3,(H,19,24)
InChIKey PULAIMIPUZMHIJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6073
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/11242282; Labnumber: SAD-0002925; IOH_ID: IOH-006074