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thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-3,5-diphenyl-
SpectraBase Compound ID 97RLKMEaYmU
InChI InChI=1S/C27H18N2O4S2/c30-21(18-11-12-22-23(13-18)33-16-32-22)15-35-27-28-25-24(20(14-34-25)17-7-3-1-4-8-17)26(31)29(27)19-9-5-2-6-10-19/h1-14H,15-16H2
InChIKey DZAKJVFTDQRJOM-UHFFFAOYSA-N
Mol Weight 498.57 g/mol
Molecular Formula C27H18N2O4S2
Exact Mass 498.070799 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1BWjPOQUUwi
Name thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-3,5-diphenyl-
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/C27H18N2O4S2/c30-21(18-11-12-22-23(13-18)33-16-32-22)15-35-27-28-25-24(20(14-34-25)17-7-3-1-4-8-17)26(31)29(27)19-9-5-2-6-10-19/h1-14H,15-16H2
InChIKey DZAKJVFTDQRJOM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_931
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/11228638