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isopropyl 2-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 2XYqspKdXzX
InChI InChI=1S/C23H25N3O3S/c1-14(2)29-23(28)20-17-10-9-16(15-7-5-4-6-8-15)13-19(17)30-22(20)25-21(27)18-11-12-24-26(18)3/h4-8,11-12,14,16H,9-10,13H2,1-3H3,(H,25,27)
InChIKey KUVHMFKQZIUVPW-UHFFFAOYSA-N
Mol Weight 423.53 g/mol
Molecular Formula C23H25N3O3S
Exact Mass 423.161663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C29ulkoaidE
Name isopropyl 2-{[(1-methyl-1H-pyrazol-5-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/C23H25N3O3S/c1-14(2)29-23(28)20-17-10-9-16(15-7-5-4-6-8-15)13-19(17)30-22(20)25-21(27)18-11-12-24-26(18)3/h4-8,11-12,14,16H,9-10,13H2,1-3H3,(H,25,27)
InChIKey KUVHMFKQZIUVPW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16075
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/1008502; Labnumber: NSB-0100723; UZI_ID: UZI-016079
Temperature 318 °C