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ethanaminium, 2-[(1,6-dihydro-4-hydroxy-6-oxo-5-pentyl-1-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride
SpectraBase Compound ID 117yJJ4zPNB
InChI InChI=1S/C19H27N3O2S.ClH/c1-4-5-7-12-16-17(23)20-19(25-14-13-21(2)3)22(18(16)24)15-10-8-6-9-11-15;/h6,8-11,23H,4-5,7,12-14H2,1-3H3;1H
InChIKey AJTXGPSUIUDDFW-UHFFFAOYSA-N
Mol Weight 397.97 g/mol
Molecular Formula C19H28ClN3O2S
Exact Mass 397.159076 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6wUCVqTWlc3
Name ethanaminium, 2-[(1,6-dihydro-4-hydroxy-6-oxo-5-pentyl-1-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride
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/C19H27N3O2S.ClH/c1-4-5-7-12-16-17(23)20-19(25-14-13-21(2)3)22(18(16)24)15-10-8-6-9-11-15;/h6,8-11,23H,4-5,7,12-14H2,1-3H3;1H
InChIKey AJTXGPSUIUDDFW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_8125
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/11218161