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acetic acid, [[3-(4-ethylphenyl)-2,3,6,7-tetrahydro-7-oxo-2-thioxothiazolo[4,5-d]pyrimidin-5-yl]thio]-
SpectraBase Compound ID 2Ra3Z4bxdG5
InChI InChI=1S/C15H13N3O3S3/c1-2-8-3-5-9(6-4-8)18-12-11(24-15(18)22)13(21)17-14(16-12)23-7-10(19)20/h3-6H,2,7H2,1H3,(H,19,20)(H,16,17,21)
InChIKey WDHQPJKHRCUXGP-UHFFFAOYSA-N
Mol Weight 379.47 g/mol
Molecular Formula C15H13N3O3S3
Exact Mass 379.011905 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JsDI5ntlZLU
Name acetic acid, [[3-(4-ethylphenyl)-2,3,6,7-tetrahydro-7-oxo-2-thioxothiazolo[4,5-d]pyrimidin-5-yl]thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C15H13N3O3S3/c1-2-8-3-5-9(6-4-8)18-12-11(24-15(18)22)13(21)17-14(16-12)23-7-10(19)20/h3-6H,2,7H2,1H3,(H,19,20)(H,16,17,21)
InChIKey WDHQPJKHRCUXGP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7374
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10328916