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benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[(trifluoroacetyl)amino]-, ethyl ester
SpectraBase Compound ID CnfhlXuhEL
InChI InChI=1S/C13H14F3NO3S/c1-2-20-11(18)9-7-5-3-4-6-8(7)21-10(9)17-12(19)13(14,15)16/h2-6H2,1H3,(H,17,19)
InChIKey HLLYMVAOPJHCIP-UHFFFAOYSA-N
Mol Weight 321.31 g/mol
Molecular Formula C13H14F3NO3S
Exact Mass 321.064649 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4GwBLmb9nOv
Name benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[(trifluoroacetyl)amino]-, ethyl 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/C13H14F3NO3S/c1-2-20-11(18)9-7-5-3-4-6-8(7)21-10(9)17-12(19)13(14,15)16/h2-6H2,1H3,(H,17,19)
InChIKey HLLYMVAOPJHCIP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2968
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/11220572; Labnumber: 5025