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methyl 2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID GpxPR8yahpM
InChI InChI=1S/C26H21NO5S/c1-31-26(30)22-18-12-11-16(15-7-3-2-4-8-15)14-21(18)33-24(22)27-23(28)19-13-17-9-5-6-10-20(17)32-25(19)29/h2-10,13,16H,11-12,14H2,1H3,(H,27,28)
InChIKey IHZKEKBBFFOFNC-UHFFFAOYSA-N
Mol Weight 459.52 g/mol
Molecular Formula C26H21NO5S
Exact Mass 459.114044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1NTITespUz
Name methyl 2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-6-phenyl-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/C26H21NO5S/c1-31-26(30)22-18-12-11-16(15-7-3-2-4-8-15)14-21(18)33-24(22)27-23(28)19-13-17-9-5-6-10-20(17)32-25(19)29/h2-10,13,16H,11-12,14H2,1H3,(H,27,28)
InChIKey IHZKEKBBFFOFNC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20604
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/9139767; Labnumber: U_AM_ACK/054024; UZI_ID: UZI-020612
Temperature 318 °C