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2-{[phenyl(phenylsulfanyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
SpectraBase Compound ID 7lcWuZUVVj4
InChI InChI=1S/C25H26N2O2S2/c26-23(28)21-19-15-9-1-2-10-16-20(19)31-25(21)27-24(29)22(17-11-5-3-6-12-17)30-18-13-7-4-8-14-18/h3-8,11-14,22H,1-2,9-10,15-16H2,(H2,26,28)(H,27,29)
InChIKey QSGOIEHXBGINND-UHFFFAOYSA-N
Mol Weight 450.62 g/mol
Molecular Formula C25H26N2O2S2
Exact Mass 450.14357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BnDJJlOGIP2
Name 2-{[phenyl(phenylsulfanyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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/C25H26N2O2S2/c26-23(28)21-19-15-9-1-2-10-16-20(19)31-25(21)27-24(29)22(17-11-5-3-6-12-17)30-18-13-7-4-8-14-18/h3-8,11-14,22H,1-2,9-10,15-16H2,(H2,26,28)(H,27,29)
InChIKey QSGOIEHXBGINND-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18683
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: UZI/9127012; UBI_ID: UBI-018686
Temperature 318 °C