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ethyl 2-({3-[(4-chlorophenoxy)methyl]benzoyl}amino)-5-(1-phenylethyl)-3-thiophenecarboxylate
SpectraBase Compound ID CtoS7RISLlb
InChI InChI=1S/C29H26ClNO4S/c1-3-34-29(33)25-17-26(19(2)21-9-5-4-6-10-21)36-28(25)31-27(32)22-11-7-8-20(16-22)18-35-24-14-12-23(30)13-15-24/h4-17,19H,3,18H2,1-2H3,(H,31,32)
InChIKey XJHPVKFWFYAHNA-UHFFFAOYSA-N
Mol Weight 520.04 g/mol
Molecular Formula C29H26ClNO4S
Exact Mass 519.127107 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FsoWhUsyZTC
Name ethyl 2-({3-[(4-chlorophenoxy)methyl]benzoyl}amino)-5-(1-phenylethyl)-3-thiophenecarboxylate
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/C29H26ClNO4S/c1-3-34-29(33)25-17-26(19(2)21-9-5-4-6-10-21)36-28(25)31-27(32)22-11-7-8-20(16-22)18-35-24-14-12-23(30)13-15-24/h4-17,19H,3,18H2,1-2H3,(H,31,32)
InChIKey XJHPVKFWFYAHNA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11028
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/1020069; Labnumber: MVY0156; UZI_ID: UZI-011030
Temperature 308 °C