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N,N,N-trimethyl-2-{[(E)-(1-(1-naphthyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}ethanaminium iodide
SpectraBase Compound ID 4rlwsfWgBpY
InChI InChI=1S/C20H22N4O3.HI/c1-24(2,3)12-11-21-13-16-18(25)22-20(27)23(19(16)26)17-10-6-8-14-7-4-5-9-15(14)17;/h4-10,13H,11-12H2,1-3H3,(H-,21,22,25,26,27);1H
InChIKey XXLISFNRXDSYPE-UHFFFAOYSA-N
Mol Weight 494.33 g/mol
Molecular Formula C20H23IN4O3
Exact Mass 494.081486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 23SRe6ShGmK
Name N,N,N-trimethyl-2-{[(E)-(1-(1-naphthyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}ethanaminium 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/C20H22N4O3.HI/c1-24(2,3)12-11-21-13-16-18(25)22-20(27)23(19(16)26)17-10-6-8-14-7-4-5-9-15(14)17;/h4-10,13H,11-12H2,1-3H3,(H-,21,22,25,26,27);1H
InChIKey XXLISFNRXDSYPE-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8989
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: D40143; Labnumber: KKA-0211-2044; SBI_ID: SBI-008992
Synonyms N,N,N-trimethyl-2-{[(1-(1-naphthyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}ethanaminium iodide
Temperature 306 °C