For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
acetamide, N-(2-phenylethyl)-2-[[2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-7-(2-propenyl)-1H-purin-8-yl]thio]-
SpectraBase Compound ID FMhTQ5CEVV2
InChI InChI=1S/C20H23N5O3S/c1-4-12-25-16-17(23(2)20(28)24(3)18(16)27)22-19(25)29-13-15(26)21-11-10-14-8-6-5-7-9-14/h4-9H,1,10-13H2,2-3H3,(H,21,26)
InChIKey CHOFNWPXSHPQKD-UHFFFAOYSA-N
Mol Weight 413.5 g/mol
Molecular Formula C20H23N5O3S
Exact Mass 413.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID G6M8p1FUj4d
Name acetamide, N-(2-phenylethyl)-2-[[2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-7-(2-propenyl)-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 413.152160792 u
Formula C20H23N5O3S
InChI InChI=1S/C20H23N5O3S/c1-4-12-25-16-17(23(2)20(28)24(3)18(16)27)22-19(25)29-13-15(26)21-11-10-14-8-6-5-7-9-14/h4-9H,1,10-13H2,2-3H3,(H,21,26)
InChIKey CHOFNWPXSHPQKD-UHFFFAOYSA-N
Molecular Weight 413.496 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17907
Solvent DMSO-d6
Source Vendor ID: NMR/11240266; Lab Info: SAD; Lab Number: 106