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

*Links on SpectraBase are not permalinks.
2(3H)-pyrimidinethione, 4-amino-5-[(2,5-dimethylphenyl)sulfonyl]-
SpectraBase Compound ID IrZuDdU9A9M
InChI InChI=1S/C12H13N3O2S2/c1-7-3-4-8(2)9(5-7)19(16,17)10-6-14-12(18)15-11(10)13/h3-6H,1-2H3,(H3,13,14,15,18)
InChIKey DGQYTOHGPAXYCM-UHFFFAOYSA-N
Mol Weight 295.37 g/mol
Molecular Formula C12H13N3O2S2
Exact Mass 295.044919 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 rZ3QCdb8lh
Name 2(3H)-pyrimidinethione, 4-amino-5-[(2,5-dimethylphenyl)sulfonyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.044919017 u
Formula C12H13N3O2S2
InChI InChI=1S/C12H13N3O2S2/c1-7-3-4-8(2)9(5-7)19(16,17)10-6-14-12(18)15-11(10)13/h3-6H,1-2H3,(H3,13,14,15,18)
InChIKey DGQYTOHGPAXYCM-UHFFFAOYSA-N
Molecular Weight 295.375 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7063
Solvent DMSO-d6
Source Vendor ID: NMR/13289854