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1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[(2-pyridinylmethyl)thio]-
SpectraBase Compound ID 8co2cbOP9uq
InChI InChI=1S/C14H15N5O2S/c1-17-10-11(18(2)14(21)19(3)12(10)20)16-13(17)22-8-9-6-4-5-7-15-9/h4-7H,8H2,1-3H3
InChIKey ZUKPSLOIJJNDAO-UHFFFAOYSA-N
Mol Weight 317.37 g/mol
Molecular Formula C14H15N5O2S
Exact Mass 317.094646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gr3OM1qrE3Y
Name 1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[(2-pyridinylmethyl)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 317.094645915 u
Formula C14H15N5O2S
InChI InChI=1S/C14H15N5O2S/c1-17-10-11(18(2)14(21)19(3)12(10)20)16-13(17)22-8-9-6-4-5-7-15-9/h4-7H,8H2,1-3H3
InChIKey ZUKPSLOIJJNDAO-UHFFFAOYSA-N
Molecular Weight 317.367 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3507
Solvent DMSO-d6
Source Vendor ID: NMR/9235140; Lab Info: LP; Lab Number: LP-3701005
Temperature 29.85 °C