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5-(ethoxymethyl)-1-[2-(4-iodophenyl)-2-oxoethyl]-2-methyl-4(1H)-pyrimidiniminium
SpectraBase Compound ID C1YaPPzhQRf
InChI InChI=1S/C16H18IN3O2/c1-3-22-10-13-8-20(11(2)19-16(13)18)9-15(21)12-4-6-14(17)7-5-12/h4-8,18H,3,9-10H2,1-2H3/p+1
InChIKey SOSGCJPBOWKXPJ-UHFFFAOYSA-O
Mol Weight 412.25 g/mol
Molecular Formula C16H19IN3O2
Exact Mass 412.052197 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DCpLqoXeYsj
Name 5-(ethoxymethyl)-1-[2-(4-iodophenyl)-2-oxoethyl]-2-methyl-4(1H)-pyrimidiniminium
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/C16H18IN3O2/c1-3-22-10-13-8-20(11(2)19-16(13)18)9-15(21)12-4-6-14(17)7-5-12/h4-8,18H,3,9-10H2,1-2H3/p+1
InChIKey SOSGCJPBOWKXPJ-UHFFFAOYSA-O
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8959
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/9031191; Labnumber: FG-04; UZI_ID: UZI-008961
Temperature 308 °C