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pyrimidinium, 1,4-dihydro-6-methyl-2-(methylthio)-5-[(phenylmethoxy)carbonyl]-, iodide
SpectraBase Compound ID 8KKiI2b4QDx
InChI InChI=1S/C14H16N2O2S.HI/c1-10-12(8-15-14(16-10)19-2)13(17)18-9-11-6-4-3-5-7-11;/h3-7H,8-9H2,1-2H3,(H,15,16);1H
InChIKey BEOUNVGYHPIDQZ-UHFFFAOYSA-N
Mol Weight 404.27 g/mol
Molecular Formula C14H17IN2O2S
Exact Mass 404.005544 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AorDgACmSt2
Name pyrimidinium, 1,4-dihydro-6-methyl-2-(methylthio)-5-[(phenylmethoxy)carbonyl]-, 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/C14H16N2O2S.HI/c1-10-12(8-15-14(16-10)19-2)13(17)18-9-11-6-4-3-5-7-11;/h3-7H,8-9H2,1-2H3,(H,15,16);1H
InChIKey BEOUNVGYHPIDQZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_1151
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/8295542; Labnumber: SHA-0000005
Temperature 303 °C