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ethyl 2-[(3-fluorobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
SpectraBase Compound ID 367HMbtbD0A
InChI InChI=1S/C20H22FNO3S/c1-2-25-20(24)17-15-10-5-3-4-6-11-16(15)26-19(17)22-18(23)13-8-7-9-14(21)12-13/h7-9,12H,2-6,10-11H2,1H3,(H,22,23)
InChIKey HXHNIYWMQMEIRH-UHFFFAOYSA-N
Mol Weight 375.46 g/mol
Molecular Formula C20H22FNO3S
Exact Mass 375.130443 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LqQumnaLLgm
Name ethyl 2-[(3-fluorobenzoyl)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/C20H22FNO3S/c1-2-25-20(24)17-15-10-5-3-4-6-11-16(15)26-19(17)22-18(23)13-8-7-9-14(21)12-13/h7-9,12H,2-6,10-11H2,1H3,(H,22,23)
InChIKey HXHNIYWMQMEIRH-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_13700
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/8117200; Labnumber: NSB0040474; UZI_ID: UZI-013704
Temperature 308 °C