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benzoic acid, 4-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, ethyl ester
SpectraBase Compound ID 79Ke7RFxvoq
InChI InChI=1S/C19H19N3O3S2/c1-4-25-19(24)13-5-7-14(8-6-13)22-15(23)9-26-17-16-11(2)12(3)27-18(16)21-10-20-17/h5-8,10H,4,9H2,1-3H3,(H,22,23)
InChIKey QPULGTDCMYKRDX-UHFFFAOYSA-N
Mol Weight 401.5 g/mol
Molecular Formula C19H19N3O3S2
Exact Mass 401.086784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LF8mOrHL3Ua
Name benzoic acid, 4-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, ethyl ester
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/C19H19N3O3S2/c1-4-25-19(24)13-5-7-14(8-6-13)22-15(23)9-26-17-16-11(2)12(3)27-18(16)21-10-20-17/h5-8,10H,4,9H2,1-3H3,(H,22,23)
InChIKey QPULGTDCMYKRDX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_977
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/11228690