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ethyl 2-{[2-(4-fluorophenoxy)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID 1in5F6NGRWz
InChI InChI=1S/C21H24FNO4S/c1-3-26-21(25)18-16-7-5-4-6-8-17(16)28-20(18)23-19(24)13(2)27-15-11-9-14(22)10-12-15/h9-13H,3-8H2,1-2H3,(H,23,24)
InChIKey NKVOQAXTJIZOSP-UHFFFAOYSA-N
Mol Weight 405.48 g/mol
Molecular Formula C21H24FNO4S
Exact Mass 405.141008 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IocRUpsUvtP
Name ethyl 2-{[2-(4-fluorophenoxy)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[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/C21H24FNO4S/c1-3-26-21(25)18-16-7-5-4-6-8-17(16)28-20(18)23-19(24)13(2)27-15-11-9-14(22)10-12-15/h9-13H,3-8H2,1-2H3,(H,23,24)
InChIKey NKVOQAXTJIZOSP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4048
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/8113703; UBI_ID: UBI-004049
Temperature 318 °C