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morpholinium, 4-[2-[(1-benzoyl-5-heptyl-1,6-dihydro-4-hydroxy-6-oxo-2-pyrimidinyl)thio]ethyl]-, chloride
SpectraBase Compound ID 8TaxsoJGhoN
InChI InChI=1S/C24H33N3O4S.ClH/c1-2-3-4-5-9-12-20-21(28)25-24(32-18-15-26-13-16-31-17-14-26)27(23(20)30)22(29)19-10-7-6-8-11-19;/h6-8,10-11,28H,2-5,9,12-18H2,1H3;1H
InChIKey PLJHNBJHDPHLDI-UHFFFAOYSA-N
Mol Weight 496.1 g/mol
Molecular Formula C24H34ClN3O4S
Exact Mass 495.195855 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5hMTzJapBMG
Name morpholinium, 4-[2-[(1-benzoyl-5-heptyl-1,6-dihydro-4-hydroxy-6-oxo-2-pyrimidinyl)thio]ethyl]-, 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 495.195855457 u
Formula C24H34ClN3O4S
InChI InChI=1S/C24H33N3O4S.ClH/c1-2-3-4-5-9-12-20-21(28)25-24(32-18-15-26-13-16-31-17-14-26)27(23(20)30)22(29)19-10-7-6-8-11-19;/h6-8,10-11,28H,2-5,9,12-18H2,1H3;1H
InChIKey PLJHNBJHDPHLDI-UHFFFAOYSA-N
Molecular Weight 496.066 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12817
Solvent DMSO-d6
Source Vendor ID: ZI/10022705; Lab Info: PLU; Lab Number: FCI-427-0025