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isopropyl 5-(aminocarbonyl)-2-{[(2-chloro-6-fluorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID GJGELaVCmY3
InChI InChI=1S/C18H18ClFN2O4S/c1-8(2)26-18(25)14-9(3)15(16(21)24)27-17(14)22-13(23)7-10-11(19)5-4-6-12(10)20/h4-6,8H,7H2,1-3H3,(H2,21,24)(H,22,23)
InChIKey CQLLYKALFNMTEB-UHFFFAOYSA-N
Mol Weight 412.86 g/mol
Molecular Formula C18H18ClFN2O4S
Exact Mass 412.065984 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 52yU2i7aFsY
Name isopropyl 5-(aminocarbonyl)-2-{[(2-chloro-6-fluorophenyl)acetyl]amino}-4-methyl-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/C18H18ClFN2O4S/c1-8(2)26-18(25)14-9(3)15(16(21)24)27-17(14)22-13(23)7-10-11(19)5-4-6-12(10)20/h4-6,8H,7H2,1-3H3,(H2,21,24)(H,22,23)
InChIKey CQLLYKALFNMTEB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15953
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/1008083; Labnumber: NSB-0100516; UZI_ID: UZI-015957
Temperature 318 °C