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ethyl 2-{[3-(2-oxo-2H-chromen-3-yl)benzoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 51v0WlhnrHK
InChI InChI=1S/C27H23NO5S/c1-2-32-27(31)23-19-11-4-6-13-22(19)34-25(23)28-24(29)18-10-7-9-16(14-18)20-15-17-8-3-5-12-21(17)33-26(20)30/h3,5,7-10,12,14-15H,2,4,6,11,13H2,1H3,(H,28,29)
InChIKey BXIOFBFOJMKTAX-UHFFFAOYSA-N
Mol Weight 473.54 g/mol
Molecular Formula C27H23NO5S
Exact Mass 473.129694 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BX54dtINSfL
Name ethyl 2-{[3-(2-oxo-2H-chromen-3-yl)benzoyl]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/C27H23NO5S/c1-2-32-27(31)23-19-11-4-6-13-22(19)34-25(23)28-24(29)18-10-7-9-16(14-18)20-15-17-8-3-5-12-21(17)33-26(20)30/h3,5,7-10,12,14-15H,2,4,6,11,13H2,1H3,(H,28,29)
InChIKey BXIOFBFOJMKTAX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12649
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: D77028; Labnumber: SPMOSE-0078; SBI_ID: SBI-012652
Temperature 318 °C