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ethyl 6-methyl-2-[(2-phenoxybutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID ANfYLdlJHZh
InChI InChI=1S/C22H27NO4S/c1-4-17(27-15-9-7-6-8-10-15)20(24)23-21-19(22(25)26-5-2)16-12-11-14(3)13-18(16)28-21/h6-10,14,17H,4-5,11-13H2,1-3H3,(H,23,24)
InChIKey XPVQTZGUOLVFTK-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 5wdWcA5sIMU
Name ethyl 6-methyl-2-[(2-phenoxybutanoyl)amino]-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/c1-4-17(27-15-9-7-6-8-10-15)20(24)23-21-19(22(25)26-5-2)16-12-11-14(3)13-18(16)28-21/h6-10,14,17H,4-5,11-13H2,1-3H3,(H,23,24)
InChIKey XPVQTZGUOLVFTK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_12304
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/6225966; Labnumber: NSB0005866; UZI_ID: UZI-012308
Temperature 318 °C