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2-(ethylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
SpectraBase Compound ID F514uScYkaB
InChI InChI=1S/C21H23N3O3S/c1-5-28-20-23-18-16(10-13-12-27-21(2,3)11-17(13)22-18)19(25)24(20)14-6-8-15(26-4)9-7-14/h6-10H,5,11-12H2,1-4H3
InChIKey OHDJYXKSVRGPKA-UHFFFAOYSA-N
Mol Weight 397.49 g/mol
Molecular Formula C21H23N3O3S
Exact Mass 397.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AODjb3DMjuf
Name 2-(ethylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-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 © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H23N3O3S/c1-5-28-20-23-18-16(10-13-12-27-21(2,3)11-17(13)22-18)19(25)24(20)14-6-8-15(26-4)9-7-14/h6-10H,5,11-12H2,1-4H3
InChIKey OHDJYXKSVRGPKA-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12269
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: 801315; Labnumber: AE95-862; VK_ID: VK-012274
Temperature 313 °C