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6-tert-Butyl-2-[(4-tert-butylbenzoyl)amino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID FKRQBJ5zAAw
InChI InChI=1S/C31H38N2O3S/c1-30(2,3)20-10-8-19(9-11-20)27(34)33-29-26(28(35)32-22-13-15-23(36-7)16-14-22)24-17-12-21(31(4,5)6)18-25(24)37-29/h8-11,13-16,21H,12,17-18H2,1-7H3,(H,32,35)(H,33,34)
InChIKey ODQFNSORJCQJOE-UHFFFAOYSA-N
Mol Weight 518.7 g/mol
Molecular Formula C31H38N2O3S
Exact Mass 518.260314 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KfFFhFJLIkI
Name benzo[b]thiophene-3-carboxamide, 6-(1,1-dimethylethyl)-2-[[4-(1,1-dimethylethyl)benzoyl]amino]-4,5,6,7-tetrahydro-N-(4-methoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 518.260314263 u
Formula C31H38N2O3S
InChI InChI=1S/C31H38N2O3S/c1-30(2,3)20-10-8-19(9-11-20)27(34)33-29-26(28(35)32-22-13-15-23(36-7)16-14-22)24-17-12-21(31(4,5)6)18-25(24)37-29/h8-11,13-16,21H,12,17-18H2,1-7H3,(H,32,35)(H,33,34)
InChIKey ODQFNSORJCQJOE-UHFFFAOYSA-N
Molecular Weight 518.716 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16911
Solvent DMSO-d6
Source Vendor ID: NMR/10311632; Lab Info: DEC; Lab Number: DEC-S000243