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methyl 6-methyl-2-[(2,2,3,3-tetrafluoro-4-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-4-oxobutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 5KJBWqvTm9g
InChI InChI=1S/C26H28F4N2O6S2/c1-11-5-7-13-15(9-11)39-19(17(13)21(33)37-3)31-23(35)25(27,28)26(29,30)24(36)32-20-18(22(34)38-4)14-8-6-12(2)10-16(14)40-20/h11-12H,5-10H2,1-4H3,(H,31,35)(H,32,36)
InChIKey FAPAIARTWGQIBM-UHFFFAOYSA-N
Mol Weight 604.63 g/mol
Molecular Formula C26H28F4N2O6S2
Exact Mass 604.132492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HVAmWJhp17S
Name methyl 6-methyl-2-[(2,2,3,3-tetrafluoro-4-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-4-oxobutanoyl)amino]-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/C26H28F4N2O6S2/c1-11-5-7-13-15(9-11)39-19(17(13)21(33)37-3)31-23(35)25(27,28)26(29,30)24(36)32-20-18(22(34)38-4)14-8-6-12(2)10-16(14)40-20/h11-12H,5-10H2,1-4H3,(H,31,35)(H,32,36)
InChIKey FAPAIARTWGQIBM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6152
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/8180621; UBI_ID: UBI-006154
Temperature 313 °C