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methyl 2-[(3,5-difluorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID D3qRTvh6Ugt
InChI InChI=1S/C16H13F2NO3S/c1-22-16(21)13-11-3-2-4-12(11)23-15(13)19-14(20)8-5-9(17)7-10(18)6-8/h5-7H,2-4H2,1H3,(H,19,20)
InChIKey ASRNNMWUJJQCFE-UHFFFAOYSA-N
Mol Weight 337.34 g/mol
Molecular Formula C16H13F2NO3S
Exact Mass 337.058421 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5GWTFLYKYU4
Name methyl 2-[(3,5-difluorobenzoyl)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/C16H13F2NO3S/c1-22-16(21)13-11-3-2-4-12(11)23-15(13)19-14(20)8-5-9(17)7-10(18)6-8/h5-7H,2-4H2,1H3,(H,19,20)
InChIKey ASRNNMWUJJQCFE-UHFFFAOYSA-N
NMR Offset 15.3247
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17455
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/9055834; UBI_ID: UBI-017458
Temperature 318 °C