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8-([2-(2-Fluorophenoxy)ethyl]sulfanyl)-9H-purin-6-ylamine
SpectraBase Compound ID 3z7gt4Xr0Ys
InChI InChI=1S/C13H12FN5OS/c14-8-3-1-2-4-9(8)20-5-6-21-13-18-10-11(15)16-7-17-12(10)19-13/h1-4,7H,5-6H2,(H3,15,16,17,18,19)
InChIKey IZUSIPCOYDRLKW-UHFFFAOYSA-N
Mol Weight 305.33 g/mol
Molecular Formula C13H12FN5OS
Exact Mass 305.074659 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3K0oFcs3qJ
Name 9H-purin-6-amine, 8-[[2-(2-fluorophenoxy)ethyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.074659362 u
Formula C13H12FN5OS
InChI InChI=1S/C13H12FN5OS/c14-8-3-1-2-4-9(8)20-5-6-21-13-18-10-11(15)16-7-17-12(10)19-13/h1-4,7H,5-6H2,(H3,15,16,17,18,19)
InChIKey IZUSIPCOYDRLKW-UHFFFAOYSA-N
Molecular Weight 305.331 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5934
Solvent DMSO-d6
Source Vendor ID: NMR/9312059; Lab Info: JSA; Lab Number: JSA-0000062