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isopropyl 2-[(4-ethoxybenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 9r6R3fm7B4w
InChI InChI=1S/C22H27NO4S/c1-5-26-16-9-7-15(8-10-16)20(24)23-21-19(22(25)27-13(2)3)17-11-6-14(4)12-18(17)28-21/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,23,24)
InChIKey BNPMXJHCSHKQSY-UHFFFAOYSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FLohx62lYKP
Name isopropyl 2-[(4-ethoxybenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-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/C22H27NO4S/c1-5-26-16-9-7-15(8-10-16)20(24)23-21-19(22(25)27-13(2)3)17-11-6-14(4)12-18(17)28-21/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,23,24)
InChIKey BNPMXJHCSHKQSY-UHFFFAOYSA-N
NMR Offset 13.7929
NMR Spectrometer Frequency 400.136
Observed nucleus 1H
Origin 1H_UZI_26187_16399
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/8123215; Labnumber: OLEG85-0005558; UZI_ID: UZI-016403
Temperature 303 °C