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4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-5,6-dihydro-, methyl ester

View entire compound with spectra: 1 NMR

4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-5,6-dihydro-, methyl ester
SpectraBase Compound ID DVBE1bQWuNe
InChI InChI=1S/C20H16Cl2N2O4S/c1-9-14(17(24-28-9)16-11(21)6-4-7-12(16)22)18(25)23-19-15(20(26)27-2)10-5-3-8-13(10)29-19/h4,6-7H,3,5,8H2,1-2H3,(H,23,25)
InChIKey ORABFULGLPKZLO-UHFFFAOYSA-N
Mol Weight 451.32 g/mol
Molecular Formula C20H16Cl2N2O4S
Exact Mass 450.020784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7oYykKgb9R5
Name 4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-5,6-dihydro-, methyl ester
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/C20H16Cl2N2O4S/c1-9-14(17(24-28-9)16-11(21)6-4-7-12(16)22)18(25)23-19-15(20(26)27-2)10-5-3-8-13(10)29-19/h4,6-7H,3,5,8H2,1-2H3,(H,23,25)
InChIKey ORABFULGLPKZLO-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3627
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: NMR/10228536