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

*Links on SpectraBase are not permalinks.

N-(3-allyl-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene)-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)aniline

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(3-allyl-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene)-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)aniline
SpectraBase Compound ID 9hnfrIMr6l8
InChI InChI=1S/C25H24FN5S/c1-2-15-30-22(18-7-11-20(26)12-8-18)17-32-25(30)27-21-13-9-19(10-14-21)24-29-28-23-6-4-3-5-16-31(23)24/h2,7-14,17H,1,3-6,15-16H2/b27-25+
InChIKey KUYPYENQWNZOFJ-IMVLJIQESA-N
Mol Weight 445.56 g/mol
Molecular Formula C25H24FN5S
Exact Mass 445.173645 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 7wMBC01ccC6
Name benzenamine, N-[(2E)-4-(4-fluorophenyl)-3-(2-propenyl)thiazolylidene]-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.173645130 u
Formula C25H24FN5S
InChI InChI=1S/C25H24FN5S/c1-2-15-30-22(18-7-11-20(26)12-8-18)17-32-25(30)27-21-13-9-19(10-14-21)24-29-28-23-6-4-3-5-16-31(23)24/h2,7-14,17H,1,3-6,15-16H2/b27-25+
InChIKey KUYPYENQWNZOFJ-IMVLJIQESA-N
Molecular Weight 445.560 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16373
Solvent DMSO-d6
Source Vendor ID: NMR/10321040; Lab Info: DEM; Lab Number: DEM-0000152