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methyl 2-{[(4-bromophenyl)acetyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID Gcw1ZNJUDNs
InChI InChI=1S/C24H22BrNO3S/c1-29-24(28)22-19-12-9-17(16-5-3-2-4-6-16)14-20(19)30-23(22)26-21(27)13-15-7-10-18(25)11-8-15/h2-8,10-11,17H,9,12-14H2,1H3,(H,26,27)
InChIKey XDMNLTYIUJXFFI-UHFFFAOYSA-N
Mol Weight 484.41 g/mol
Molecular Formula C24H22BrNO3S
Exact Mass 483.050378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIncHb7xPBk
Name methyl 2-{[(4-bromophenyl)acetyl]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/C24H22BrNO3S/c1-29-24(28)22-19-12-9-17(16-5-3-2-4-6-16)14-20(19)30-23(22)26-21(27)13-15-7-10-18(25)11-8-15/h2-8,10-11,17H,9,12-14H2,1H3,(H,26,27)
InChIKey XDMNLTYIUJXFFI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20601
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/9129299; Labnumber: U_AM_ACK/053966; UZI_ID: UZI-020609
Temperature 318 °C