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4-chloro-5-(4-isopropoxybenzyl)-2-(methylsulfanyl)-6-(1-piperidinyl)pyrimidine

View entire compound with spectra: 1 NMR

4-chloro-5-(4-isopropoxybenzyl)-2-(methylsulfanyl)-6-(1-piperidinyl)pyrimidine
SpectraBase Compound ID GMXdM9bWSOR
InChI InChI=1S/C20H26ClN3OS/c1-14(2)25-16-9-7-15(8-10-16)13-17-18(21)22-20(26-3)23-19(17)24-11-5-4-6-12-24/h7-10,14H,4-6,11-13H2,1-3H3
InChIKey IQPDFYWMXXJBQJ-UHFFFAOYSA-N
Mol Weight 391.96 g/mol
Molecular Formula C20H26ClN3OS
Exact Mass 391.148511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AqQEHX42WGD
Name 4-chloro-5-(4-isopropoxybenzyl)-2-(methylsulfanyl)-6-(1-piperidinyl)pyrimidine
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/C20H26ClN3OS/c1-14(2)25-16-9-7-15(8-10-16)13-17-18(21)22-20(26-3)23-19(17)24-11-5-4-6-12-24/h7-10,14H,4-6,11-13H2,1-3H3
InChIKey IQPDFYWMXXJBQJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12392
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: 100516; Labnumber: LAM-260; VK_ID: VK-012397
Synonyms 4-{[4-chloro-2-(methylsulfanyl)-6-(1-piperidinyl)-5-pyrimidinyl]methyl}phenyl isopropyl ether
Temperature 318 °C