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acetamide, N-(2-ethyl-6-methylphenyl)-2-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)thio]-
SpectraBase Compound ID 6fg94w94HYt
InChI InChI=1S/C19H23N5O3S/c1-6-12-9-7-8-11(2)14(12)20-13(25)10-28-18-21-16-15(22(18)3)17(26)24(5)19(27)23(16)4/h7-9H,6,10H2,1-5H3,(H,20,25)
InChIKey TVDHPDRKIFQJBK-UHFFFAOYSA-N
Mol Weight 401.49 g/mol
Molecular Formula C19H23N5O3S
Exact Mass 401.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 83fgfTwQ9al
Name acetamide, N-(2-ethyl-6-methylphenyl)-2-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)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 401.152160792 u
Formula C19H23N5O3S
InChI InChI=1S/C19H23N5O3S/c1-6-12-9-7-8-11(2)14(12)20-13(25)10-28-18-21-16-15(22(18)3)17(26)24(5)19(27)23(16)4/h7-9H,6,10H2,1-5H3,(H,20,25)
InChIKey TVDHPDRKIFQJBK-UHFFFAOYSA-N
Molecular Weight 401.485 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1582
Solvent DMSO-d6
Source Vendor ID: NMR/8316051; Lab Info: LP; Lab Number: LP-3700508