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Methyl 2-{[3-(3-methylphenoxy)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID CMMHRM5GU09
InChI InChI=1S/C20H23NO4S/c1-13-6-5-7-14(12-13)25-11-10-17(22)21-19-18(20(23)24-2)15-8-3-4-9-16(15)26-19/h5-7,12H,3-4,8-11H2,1-2H3,(H,21,22)
InChIKey LSKIVJTVEIXEIO-UHFFFAOYSA-N
Mol Weight 373.47 g/mol
Molecular Formula C20H23NO4S
Exact Mass 373.134779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7XHhNt0LXcS
Name methyl 2-{[3-(3-methylphenoxy)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H23NO4S/c1-13-6-5-7-14(12-13)25-11-10-17(22)21-19-18(20(23)24-2)15-8-3-4-9-16(15)26-19/h5-7,12H,3-4,8-11H2,1-2H3,(H,21,22)
InChIKey LSKIVJTVEIXEIO-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2001
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: D02140; Labnumber: IBS2-025; SBI_ID: SBI-002003
Temperature 306 °C