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N-(1-adamantyl)-2-{[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridinyl]sulfanyl}acetamide
SpectraBase Compound ID DKRfiZ4MrQu
InChI InChI=1S/C28H27N3OS2/c29-16-23-22(25-7-4-8-33-25)12-24(21-5-2-1-3-6-21)30-27(23)34-17-26(32)31-28-13-18-9-19(14-28)11-20(10-18)15-28/h1-8,12,18-20H,9-11,13-15,17H2,(H,31,32)/t18-,19+,20-,28-
InChIKey YJMDMXPPWMIPBG-SEAGLFGOSA-N
Mol Weight 485.66 g/mol
Molecular Formula C28H27N3OS2
Exact Mass 485.159555 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IgEjh69BnPq
Name N-(1-adamantyl)-2-{[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridinyl]sulfanyl}acetamide
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/C28H27N3OS2/c29-16-23-22(25-7-4-8-33-25)12-24(21-5-2-1-3-6-21)30-27(23)34-17-26(32)31-28-13-18-9-19(14-28)11-20(10-18)15-28/h1-8,12,18-20H,9-11,13-15,17H2,(H,31,32)/t18-,19+,20-,28-
InChIKey YJMDMXPPWMIPBG-SEAGLFGOSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9885
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: 132483; Labnumber: SHES1-011; VK_ID: VK-009889
Temperature 308 °C