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6-Methyl-N-o-phenetyl-2-(o-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide

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6-Methyl-N-o-phenetyl-2-(o-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
SpectraBase Compound ID 4oyVScRuubA
InChI InChI=1S/C26H28N2O3S/c1-4-31-21-12-8-7-11-20(21)27-25(30)23-19-14-13-16(2)15-22(19)32-26(23)28-24(29)18-10-6-5-9-17(18)3/h5-12,16H,4,13-15H2,1-3H3,(H,27,30)(H,28,29)
InChIKey MKKFGVIWGVCBGI-UHFFFAOYSA-N
Mol Weight 448.58 g/mol
Molecular Formula C26H28N2O3S
Exact Mass 448.182064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JudCI1oc6GO
Name benzo[b]thiophene-3-carboxamide, N-(2-ethoxyphenyl)-4,5,6,7-tetrahydro-6-methyl-2-[(2-methylbenzoyl)amino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.182063941 u
Formula C26H28N2O3S
InChI InChI=1S/C26H28N2O3S/c1-4-31-21-12-8-7-11-20(21)27-25(30)23-19-14-13-16(2)15-22(19)32-26(23)28-24(29)18-10-6-5-9-17(18)3/h5-12,16H,4,13-15H2,1-3H3,(H,27,30)(H,28,29)
InChIKey MKKFGVIWGVCBGI-UHFFFAOYSA-N
Molecular Weight 448.581 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5636
Solvent DMSO-d6
Source Vendor ID: NMR/9290931; Lab Info: DEC; Lab Number: DEC-S001113