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4'-chloro-2-[(4-hydroxy-5-methyl-6-propyl-2-pyrimidinyl)thio]acetophenone, dimethyl carbamate (ester)

View entire compound with spectra: 2 NMR, and 1 FTIR

4'-chloro-2-[(4-hydroxy-5-methyl-6-propyl-2-pyrimidinyl)thio]acetophenone, dimethyl carbamate (ester)
SpectraBase Compound ID 46DtuaJRueT
InChI InChI=1S/C19H22ClN3O3S/c1-5-6-15-12(2)17(26-19(25)23(3)4)22-18(21-15)27-11-16(24)13-7-9-14(20)10-8-13/h7-10H,5-6,11H2,1-4H3
InChIKey JRZQVQNOLPELKO-UHFFFAOYSA-N
Mol Weight 407.92 g/mol
Molecular Formula C19H22ClN3O3S
Exact Mass 407.10704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BrIWrQrZ4it
Name 4'-CHLORO-2-[(4-HYDROXY-5-METHYL-6-PROPYL-2-PYRIMIDINYL)THIO]ACETOPHENONE, DIMETHYLCARBAMATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22ClN3O3S
InChI InChI=1S/C19H22ClN3O3S/c1-5-6-15-12(2)17(26-19(25)23(3)4)22-18(21-15)27-11-16(24)13-7-9-14(20)10-8-13/h7-10H,5-6,11H2,1-4H3
InChIKey JRZQVQNOLPELKO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 113-115C
Molecular Weight 407.92
Solvent CDCl3; Reference=TMS; Temperature 297K