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8-(4-Fluoro-phenoxy)-9-isopropyl-1,3-dimethyl-3,9-dihydro-purine-2,6-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

8-(4-Fluoro-phenoxy)-9-isopropyl-1,3-dimethyl-3,9-dihydro-purine-2,6-dione
SpectraBase Compound ID CHR7TcFHULt
InChI InChI=1S/C16H17FN4O3/c1-9(2)21-13-12(14(22)20(4)16(23)19(13)3)18-15(21)24-11-7-5-10(17)6-8-11/h5-9H,1-4H3
InChIKey JEOZYCPFSRQUMD-UHFFFAOYSA-N
Mol Weight 332.34 g/mol
Molecular Formula C16H17FN4O3
Exact Mass 332.128469 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4RBI35HFhbc
Name 1H-purine-2,6-dione, 8-(4-fluorophenoxy)-3,9-dihydro-1,3-dimethyl-9-(1-methylethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.128468583 u
Formula C16H17FN4O3
InChI InChI=1S/C16H17FN4O3/c1-9(2)21-13-12(14(22)20(4)16(23)19(13)3)18-15(21)24-11-7-5-10(17)6-8-11/h5-9H,1-4H3
InChIKey JEOZYCPFSRQUMD-UHFFFAOYSA-N
Molecular Weight 332.335 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15123
Solvent DMSO-d6
Source Vendor ID: NMR/10322575; Lab Info: SAD; Lab Number: 2716