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ethyl 2-{[(4-chlorophenyl)sulfonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
SpectraBase Compound ID BrRkzXvrLG6
InChI InChI=1S/C19H22ClNO4S2/c1-2-25-19(22)17-15-7-5-3-4-6-8-16(15)26-18(17)21-27(23,24)14-11-9-13(20)10-12-14/h9-12,21H,2-8H2,1H3
InChIKey YQVLLHXATWDAAU-UHFFFAOYSA-N
Mol Weight 427.96 g/mol
Molecular Formula C19H22ClNO4S2
Exact Mass 427.067878 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DSygHQahHQ3
Name ethyl 2-{[(4-chlorophenyl)sulfonyl]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/C19H22ClNO4S2/c1-2-25-19(22)17-15-7-5-3-4-6-8-16(15)26-18(17)21-27(23,24)14-11-9-13(20)10-12-14/h9-12,21H,2-8H2,1H3
InChIKey YQVLLHXATWDAAU-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17592
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/9061666; UBI_ID: UBI-017595
Temperature 318 °C