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1H-purine-2,6-dione, 8-[4-[(2-amino-4-methyl-5-thiazolyl)methyl]phenoxy]-3,7-dihydro-1,3,7-trimethyl-
SpectraBase Compound ID GkDJicEwgeO
InChI InChI=1S/C19H20N6O3S/c1-10-13(29-17(20)21-10)9-11-5-7-12(8-6-11)28-18-22-15-14(23(18)2)16(26)25(4)19(27)24(15)3/h5-8H,9H2,1-4H3,(H2,20,21)
InChIKey KTQCJEBLMGEAJF-UHFFFAOYSA-N
Mol Weight 412.47 g/mol
Molecular Formula C19H20N6O3S
Exact Mass 412.13176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3gNRNLGtXVi
Name 1H-purine-2,6-dione, 8-[4-[(2-amino-4-methyl-5-thiazolyl)methyl]phenoxy]-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 412.131759699 u
Formula C19H20N6O3S
InChI InChI=1S/C19H20N6O3S/c1-10-13(29-17(20)21-10)9-11-5-7-12(8-6-11)28-18-22-15-14(23(18)2)16(26)25(4)19(27)24(15)3/h5-8H,9H2,1-4H3,(H2,20,21)
InChIKey KTQCJEBLMGEAJF-UHFFFAOYSA-N
Molecular Weight 412.468 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14623
Solvent DMSO-d6
Source Vendor ID: NMR/10310684; Lab Info: SAD; Lab Number: 18