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3-(4-butylphenyl)-6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID H0On7VZD5L6
InChI InChI=1S/C17H18N2OS2/c1-3-4-5-12-6-8-13(9-7-12)19-16(20)14-10-11(2)22-15(14)18-17(19)21/h6-10H,3-5H2,1-2H3,(H,18,21)
InChIKey HFGOSTKWRAUDTJ-UHFFFAOYSA-N
Mol Weight 330.46 g/mol
Molecular Formula C17H18N2OS2
Exact Mass 330.086056 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1EOBAGSjPf0
Name 3-(4-butylphenyl)-6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
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/C17H18N2OS2/c1-3-4-5-12-6-8-13(9-7-12)19-16(20)14-10-11(2)22-15(14)18-17(19)21/h6-10H,3-5H2,1-2H3,(H,18,21)
InChIKey HFGOSTKWRAUDTJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7298
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: UZI/1268600; Labnumber: COL4727; UZI_ID: UZI-007300
Temperature 318 °C