2-Amino-1-(2-fluoro-phenyl)-4,4-bis-trifluoromethyl-4,5,6,7,8,9-hexahydro-1H-cyclohepta[b]pyridine-3-carbonitrile

SpectraBase Compound ID	9fNhu4JerGS
InChI	InChI=1S/C19H16F7N3/c20-13-7-4-5-9-15(13)29-14-8-3-1-2-6-11(14)17(18(21,22)23,19(24,25)26)12(10-27)16(29)28/h4-5,7,9H,1-3,6,8,28H2
InChIKey	MTGVSBKUJTUSHK-UHFFFAOYSA-N Google Search
Mol Weight	419.35 g/mol
Molecular Formula	C19H16F7N3
Exact Mass	419.123245 g/mol

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SpectraBase Spectrum ID	JIdTS2pYDXO
Name	2-amino-1-(2-fluorophenyl)-4,4-bis(trifluoromethyl)-4,5,6,7,8,9-hexahydro-1H-cyclohepta[b]pyridine-3-carbonitrile
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/C19H16F7N3/c20-13-7-4-5-9-15(13)29-14-8-3-1-2-6-11(14)17(18(21,22)23,19(24,25)26)12(10-27)16(29)28/h4-5,7,9H,1-3,6,8,28H2
InChIKey	MTGVSBKUJTUSHK-UHFFFAOYSA-N
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_2637
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/9290707; Labnumber: AU-0000413