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1-(4-{(E)-[4-(trifluoromethyl)phenyl]diazenyl}phenyl)hexahydro-1H-azepine
SpectraBase Compound ID WnVKjAgrxw
InChI InChI=1S/C19H20F3N3/c20-19(21,22)15-5-7-16(8-6-15)23-24-17-9-11-18(12-10-17)25-13-3-1-2-4-14-25/h5-12H,1-4,13-14H2/b24-23+
InChIKey MFKCKNCEXHDLNG-WCWDXBQESA-N
Mol Weight 347.39 g/mol
Molecular Formula C19H20F3N3
Exact Mass 347.160932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AAGdcMtrC85
Name 1-(4-{(E)-[4-(trifluoromethyl)phenyl]diazenyl}phenyl)hexahydro-1H-azepine
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/C19H20F3N3/c20-19(21,22)15-5-7-16(8-6-15)23-24-17-9-11-18(12-10-17)25-13-3-1-2-4-14-25/h5-12H,1-4,13-14H2/b24-23+
InChIKey MFKCKNCEXHDLNG-WCWDXBQESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15408
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: 987/00001942; Labnumber: 987/00001942218823; VK_ID: VK-015413
Synonyms 1-(4-{[4-(trifluoromethyl)phenyl]diazenyl}phenyl)hexahydro-1H-azepine
Temperature 318 °C