For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-fluorobenzamide
SpectraBase Compound ID 2a4XvcghUE4
InChI InChI=1S/C19H14F7N3OS/c20-13-7-3-1-6-11(13)15(30)28-17(18(21,22)23,19(24,25)26)29-16-12(9-27)10-5-2-4-8-14(10)31-16/h1,3,6-7,29H,2,4-5,8H2,(H,28,30)
InChIKey MVCIHNZGBQHONN-UHFFFAOYSA-N
Mol Weight 465.39 g/mol
Molecular Formula C19H14F7N3OS
Exact Mass 465.07458 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8AqTtmDM6E3
Name N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-fluorobenzamide
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/C19H14F7N3OS/c20-13-7-3-1-6-11(13)15(30)28-17(18(21,22)23,19(24,25)26)29-16-12(9-27)10-5-2-4-8-14(10)31-16/h1,3,6-7,29H,2,4-5,8H2,(H,28,30)
InChIKey MVCIHNZGBQHONN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4637
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: NMR/9233262; Labnumber: AU-0000668; IOH_ID: IOH-004638
Temperature 303 °C