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

*Links on SpectraBase are not permalinks.
acetamide, 2-[[7-[(4-bromophenyl)methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]thio]-N-(2-phenylethyl)-
SpectraBase Compound ID DzZotChaomV
InChI InChI=1S/C24H24BrN5O3S/c1-28-21-20(22(32)29(2)24(28)33)30(14-17-8-10-18(25)11-9-17)23(27-21)34-15-19(31)26-13-12-16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,26,31)
InChIKey NRHOGANMVGXXMC-UHFFFAOYSA-N
Mol Weight 542.45 g/mol
Molecular Formula C24H24BrN5O3S
Exact Mass 541.078324 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 Jy0PRMywiBy
Name acetamide, 2-[[7-[(4-bromophenyl)methyl]-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 541.078323824 u
Formula C24H24BrN5O3S
InChI InChI=1S/C24H24BrN5O3S/c1-28-21-20(22(32)29(2)24(28)33)30(14-17-8-10-18(25)11-9-17)23(27-21)34-15-19(31)26-13-12-16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,26,31)
InChIKey NRHOGANMVGXXMC-UHFFFAOYSA-N
Molecular Weight 542.452 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17800
Solvent DMSO-d6
Source Vendor ID: NMR/10320394; Lab Info: SAD; Lab Number: SAD-dast004