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ethyl 2-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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ethyl 2-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 4k6Rkru9JH3
InChI InChI=1S/C19H17F12NO3S/c1-3-35-12(33)10-8-5-4-7(2)6-9(8)36-11(10)32-14(34)16(24,25)18(28,29)19(30,31)17(26,27)15(22,23)13(20)21/h7,13H,3-6H2,1-2H3,(H,32,34)
InChIKey NVPNELLFLKVHNL-UHFFFAOYSA-N
Mol Weight 567.39 g/mol
Molecular Formula C19H17F12NO3S
Exact Mass 567.073753 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JYTaK4ciPi0
Name ethyl 2-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)amino]-6-methyl-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/C19H17F12NO3S/c1-3-35-12(33)10-8-5-4-7(2)6-9(8)36-11(10)32-14(34)16(24,25)18(28,29)19(30,31)17(26,27)15(22,23)13(20)21/h7,13H,3-6H2,1-2H3,(H,32,34)
InChIKey NVPNELLFLKVHNL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_17428
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/6041085; Labnumber: SB-030; UZI_ID: UZI-017435
Temperature 318 °C