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2-(heptylsulfanyl)-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 CjivRtqYcpa
InChI InChI=1S/C26H33N3O3S/c1-5-6-7-8-9-14-33-25-28-23-21(15-18-17-32-26(2,3)16-22(18)27-23)24(30)29(25)19-10-12-20(31-4)13-11-19/h10-13,15H,5-9,14,16-17H2,1-4H3
InChIKey METFENKPNSJDKB-UHFFFAOYSA-N
Mol Weight 467.6 g/mol
Molecular Formula C26H33N3O3S
Exact Mass 467.224263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 27BYunbkPbr
Name 2-(heptylsulfanyl)-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/C26H33N3O3S/c1-5-6-7-8-9-14-33-25-28-23-21(15-18-17-32-26(2,3)16-22(18)27-23)24(30)29(25)19-10-12-20(31-4)13-11-19/h10-13,15H,5-9,14,16-17H2,1-4H3
InChIKey METFENKPNSJDKB-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12260
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: 801303; Labnumber: AE95-850; VK_ID: VK-012265
Temperature 313 °C