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2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-3-phenyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

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2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-3-phenyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 1FjvP2eEHNE
InChI InChI=1S/C26H22ClN3O3S/c1-26(2)13-21-17(14-33-26)12-20-23(28-21)29-25(30(24(20)32)19-6-4-3-5-7-19)34-15-22(31)16-8-10-18(27)11-9-16/h3-12H,13-15H2,1-2H3
InChIKey POKUAZCLXVNNAD-UHFFFAOYSA-N
Mol Weight 491.99 g/mol
Molecular Formula C26H22ClN3O3S
Exact Mass 491.10704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9INIiTMrgDY
Name 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-3-phenyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H22ClN3O3S/c1-26(2)13-21-17(14-33-26)12-20-23(28-21)29-25(30(24(20)32)19-6-4-3-5-7-19)34-15-22(31)16-8-10-18(27)11-9-16/h3-12H,13-15H2,1-2H3
InChIKey POKUAZCLXVNNAD-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12164
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 801270; Labnumber: AE95-814; VK_ID: VK-012169
Temperature 318 °C