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acetamide, 2-[(7-ethyl-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)thio]-N-(2-phenylethyl)-
SpectraBase Compound ID 677dd8gLIm
InChI InChI=1S/C19H23N5O3S/c1-4-24-15-16(22(2)19(27)23(3)17(15)26)21-18(24)28-12-14(25)20-11-10-13-8-6-5-7-9-13/h5-9H,4,10-12H2,1-3H3,(H,20,25)
InChIKey QRXYXTDZGCVOJT-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 3PmlHsjIs0U
Name acetamide, 2-[(7-ethyl-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)thio]-N-(2-phenylethyl)-
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/c1-4-24-15-16(22(2)19(27)23(3)17(15)26)21-18(24)28-12-14(25)20-11-10-13-8-6-5-7-9-13/h5-9H,4,10-12H2,1-3H3,(H,20,25)
InChIKey QRXYXTDZGCVOJT-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_17787
Solvent DMSO-d6
Source Vendor ID: NMR/11240267; Lab Info: SAD; Lab Number: 107