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1H-purine-2,6-dione, 8-[[2-(4-fluorophenoxy)ethyl]amino]-3,7-dihydro-1,3,7-trimethyl-
SpectraBase Compound ID B8rvzdKSq3H
InChI InChI=1S/C16H18FN5O3/c1-20-12-13(21(2)16(24)22(3)14(12)23)19-15(20)18-8-9-25-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3,(H,18,19)
InChIKey SHOSFUDBVRCKSW-UHFFFAOYSA-N
Mol Weight 347.35 g/mol
Molecular Formula C16H18FN5O3
Exact Mass 347.139368 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8qTmMPUMJrU
Name 1H-purine-2,6-dione, 8-[[2-(4-fluorophenoxy)ethyl]amino]-3,7-dihydro-1,3,7-trimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.139367620 u
Formula C16H18FN5O3
InChI InChI=1S/C16H18FN5O3/c1-20-12-13(21(2)16(24)22(3)14(12)23)19-15(20)18-8-9-25-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3,(H,18,19)
InChIKey SHOSFUDBVRCKSW-UHFFFAOYSA-N
Molecular Weight 347.350 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5046
Solvent DMSO-d6
Source Vendor ID: NMR/9290340; Lab Info: LP; Lab Number: LP-KV00990