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ethyl 2-[(2,6-dichlorobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
SpectraBase Compound ID BDIEEWLgMqP
InChI InChI=1S/C20H21Cl2NO3S/c1-2-26-20(25)16-12-8-5-3-4-6-11-15(12)27-19(16)23-18(24)17-13(21)9-7-10-14(17)22/h7,9-10H,2-6,8,11H2,1H3,(H,23,24)
InChIKey BGODKEFQUAUFLP-UHFFFAOYSA-N
Mol Weight 426.36 g/mol
Molecular Formula C20H21Cl2NO3S
Exact Mass 425.06192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID uVnxxDq4pz
Name ethyl 2-[(2,6-dichlorobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[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/C20H21Cl2NO3S/c1-2-26-20(25)16-12-8-5-3-4-6-11-15(12)27-19(16)23-18(24)17-13(21)9-7-10-14(17)22/h7,9-10H,2-6,8,11H2,1H3,(H,23,24)
InChIKey BGODKEFQUAUFLP-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2275
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/8049129; UBI_ID: UBI-002276
Temperature 318 °C