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2-(1-adamantyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide
SpectraBase Compound ID 1NhVVoiNW7A
InChI InChI=1S/C25H34N2OS/c1-24(2,3)18-4-5-19-20(14-26)23(29-21(19)9-18)27-22(28)13-25-10-15-6-16(11-25)8-17(7-15)12-25/h15-18H,4-13H2,1-3H3,(H,27,28)/t15-,16+,17-,18?,25-
InChIKey CTRRTORETIZURN-LEFTVOEWSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H34N2OS
Exact Mass 410.239185 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FxFrQMtMbbr
Name 2-(1-adamantyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)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/C25H34N2OS/c1-24(2,3)18-4-5-19-20(14-26)23(29-21(19)9-18)27-22(28)13-25-10-15-6-16(11-25)8-17(7-15)12-25/h15-18H,4-13H2,1-3H3,(H,27,28)/t15-,16+,17-,18?,25-
InChIKey CTRRTORETIZURN-LEFTVOEWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2438
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: 9262123; UBI_ID: UBI-002439
Temperature 318 °C