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3-chloro-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl)-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 2dMMSNL8cYv
InChI InChI=1S/C24H25ClN2OS2/c25-21-17-12-9-10-14-20(17)29-22(21)23(28)27-24-18(15-26)16-11-7-5-3-1-2-4-6-8-13-19(16)30-24/h9-10,12,14H,1-8,11,13H2,(H,27,28)
InChIKey HRRJFLYZEMMNQR-UHFFFAOYSA-N
Mol Weight 457.05 g/mol
Molecular Formula C24H25ClN2OS2
Exact Mass 456.109683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2Hj27UkgZmO
Name 3-chloro-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl)-1-benzothiophene-2-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/C24H25ClN2OS2/c25-21-17-12-9-10-14-20(17)29-22(21)23(28)27-24-18(15-26)16-11-7-5-3-1-2-4-6-8-13-19(16)30-24/h9-10,12,14H,1-8,11,13H2,(H,27,28)
InChIKey HRRJFLYZEMMNQR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19599
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/9145732; UBI_ID: UBI-019603
Temperature 318 °C