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ethyl 2-{[(4,5-dibromo-2-thienyl)carbonyl]amino}-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate
SpectraBase Compound ID 6rLGimEyhd9
InChI InChI=1S/C23H29Br2NO3S2/c1-2-29-23(28)19-15-12-10-8-6-4-3-5-7-9-11-13-17(15)31-22(19)26-21(27)18-14-16(24)20(25)30-18/h14H,2-13H2,1H3,(H,26,27)
InChIKey BIXILAYNDLLVQO-UHFFFAOYSA-N
Mol Weight 591.42 g/mol
Molecular Formula C23H29Br2NO3S2
Exact Mass 588.995562 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J7OfKScFESg
Name ethyl 2-{[(4,5-dibromo-2-thienyl)carbonyl]amino}-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate
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/C23H29Br2NO3S2/c1-2-29-23(28)19-15-12-10-8-6-4-3-5-7-9-11-13-17(15)31-22(19)26-21(27)18-14-16(24)20(25)30-18/h14H,2-13H2,1H3,(H,26,27)
InChIKey BIXILAYNDLLVQO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6399
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/1023799; Labnumber: COL1503; UZI_ID: UZI-006401
Temperature 318 °C