5-(4-fluorophenyl)-2-(hexahydro-1H-azepin-1-ylcarbonyl)-7-(1,1,2,2,2-pentafluoroethyl)pyrazolo[1,5-a]pyrimidine

SpectraBase Compound ID	CIyMKpnePTR
InChI	InChI=1S/C21H18F6N4O/c22-14-7-5-13(6-8-14)15-11-17(20(23,24)21(25,26)27)31-18(28-15)12-16(29-31)19(32)30-9-3-1-2-4-10-30/h5-8,11-12H,1-4,9-10H2
InChIKey	DWSANLVKFGIGJV-UHFFFAOYSA-N Google Search
Mol Weight	456.39 g/mol
Molecular Formula	C21H18F6N4O
Exact Mass	456.13848 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	BalIZsZHmFH
Name	5-(4-fluorophenyl)-2-(hexahydro-1H-azepin-1-ylcarbonyl)-7-(1,1,2,2,2-pentafluoroethyl)pyrazolo[1,5-a]pyrimidine
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/C21H18F6N4O/c22-14-7-5-13(6-8-14)15-11-17(20(23,24)21(25,26)27)31-18(28-15)12-16(29-31)19(32)30-9-3-1-2-4-10-30/h5-8,11-12H,1-4,9-10H2
InChIKey	DWSANLVKFGIGJV-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_1344
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/1229896; Labnumber: AC-NHALL/1271943; UZI_ID: UZI-001346
Temperature	313 °C