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N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
SpectraBase Compound ID EXRHvikBihg
InChI InChI=1S/C19H19F9N2OS/c1-4-15(2,3)9-5-6-10-11(8-29)13(32-12(10)7-9)30-14(31)16(20,21)17(22,23)18(24,25)19(26,27)28/h9H,4-7H2,1-3H3,(H,30,31)
InChIKey JAGLAGOPNGKZAD-UHFFFAOYSA-N
Mol Weight 494.42 g/mol
Molecular Formula C19H19F9N2OS
Exact Mass 494.107438 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2ChN47dy4A6
Name N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
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/C19H19F9N2OS/c1-4-15(2,3)9-5-6-10-11(8-29)13(32-12(10)7-9)30-14(31)16(20,21)17(22,23)18(24,25)19(26,27)28/h9H,4-7H2,1-3H3,(H,30,31)
InChIKey JAGLAGOPNGKZAD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16961
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/8199685; UBI_ID: UBI-016964
Temperature 318 °C