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ethanaminium, 2-[(1,6-dihydro-4-hydroxy-6-oxo-5-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride
SpectraBase Compound ID 3y2skbY2KsU
InChI InChI=1S/C14H17N3O2S.ClH/c1-17(2)8-9-20-14-15-12(18)11(13(19)16-14)10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3,(H2,15,16,18,19);1H
InChIKey SWJMWWPYAGFZOT-UHFFFAOYSA-N
Mol Weight 327.83 g/mol
Molecular Formula C14H18ClN3O2S
Exact Mass 327.080826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IQkf5wAgZIS
Name ethanaminium, 2-[(1,6-dihydro-4-hydroxy-6-oxo-5-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.080825704 u
Formula C14H18ClN3O2S
InChI InChI=1S/C14H17N3O2S.ClH/c1-17(2)8-9-20-14-15-12(18)11(13(19)16-14)10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3,(H2,15,16,18,19);1H
InChIKey SWJMWWPYAGFZOT-UHFFFAOYSA-N
Molecular Weight 327.830 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12815
Solvent DMSO-d6
Source Vendor ID: ZI/10021945; Lab Info: PLU; Lab Number: FCI-427-0055