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N-[1-[(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-furamide
SpectraBase Compound ID 4tMXYsD3gQC
InChI InChI=1S/C19H17F6N3O2S/c20-18(21,22)17(19(23,24)25,27-15(29)13-7-5-9-30-13)28-16-12(10-26)11-6-3-1-2-4-8-14(11)31-16/h5,7,9,28H,1-4,6,8H2,(H,27,29)
InChIKey NJIPAOKTFMNRNW-UHFFFAOYSA-N
Mol Weight 465.41 g/mol
Molecular Formula C19H17F6N3O2S
Exact Mass 465.094567 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G1wNmNCi6JC
Name N-[1-[(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-furamide
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/C19H17F6N3O2S/c20-18(21,22)17(19(23,24)25,27-15(29)13-7-5-9-30-13)28-16-12(10-26)11-6-3-1-2-4-8-14(11)31-16/h5,7,9,28H,1-4,6,8H2,(H,27,29)
InChIKey NJIPAOKTFMNRNW-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20241
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: D16437; Labnumber: SOK-1212; SBI_ID: SBI-020245
Temperature 315 °C