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pyrimidinium, 1,4-dihydro-2-(methylthio)-6-phenyl-5-(phenylsulfonyl)-, iodide

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pyrimidinium, 1,4-dihydro-2-(methylthio)-6-phenyl-5-(phenylsulfonyl)-, iodide
SpectraBase Compound ID Bw3E53EHruF
InChI InChI=1S/C17H16N2O2S2.HI/c1-22-17-18-12-15(16(19-17)13-8-4-2-5-9-13)23(20,21)14-10-6-3-7-11-14;/h2-11H,12H2,1H3,(H,18,19);1H
InChIKey LEFJVEACKAHCMT-UHFFFAOYSA-N
Mol Weight 472.36 g/mol
Molecular Formula C17H17IN2O2S2
Exact Mass 471.977615 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KOw1s3pHXyo
Name pyrimidinium, 1,4-dihydro-2-(methylthio)-6-phenyl-5-(phenylsulfonyl)-, iodide
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/C17H16N2O2S2.HI/c1-22-17-18-12-15(16(19-17)13-8-4-2-5-9-13)23(20,21)14-10-6-3-7-11-14;/h2-11H,12H2,1H3,(H,18,19);1H
InChIKey LEFJVEACKAHCMT-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_1148
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/8295538; Labnumber: SHA-0000001
Temperature 303 °C