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ethyl 2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID HTO6zd08spP
InChI InChI=1S/C21H19ClN2O4S/c1-3-27-21(26)17-13-8-6-10-15(13)29-20(17)23-19(25)16-11(2)28-24-18(16)12-7-4-5-9-14(12)22/h4-5,7,9H,3,6,8,10H2,1-2H3,(H,23,25)
InChIKey WZQWSCBGKXQQQH-UHFFFAOYSA-N
Mol Weight 430.91 g/mol
Molecular Formula C21H19ClN2O4S
Exact Mass 430.075406 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7DfjUoTWk7B
Name ethyl 2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[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/C21H19ClN2O4S/c1-3-27-21(26)17-13-8-6-10-15(13)29-20(17)23-19(25)16-11(2)28-24-18(16)12-7-4-5-9-14(12)22/h4-5,7,9H,3,6,8,10H2,1-2H3,(H,23,25)
InChIKey WZQWSCBGKXQQQH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_14404
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/9040900; Labnumber: NSB0063999; UZI_ID: UZI-014408
Temperature 318 °C