2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-3-(cyclohexylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

SpectraBase Compound ID	JOmiF94thTb
InChI	InChI=1S/C31H33ClN2O2S/c32-24-14-12-22(13-15-24)26(35)20-37-30-33-28-25-11-5-4-10-23(25)18-31(16-6-7-17-31)27(28)29(36)34(30)19-21-8-2-1-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey	VNSQUGRUINKNPD-UHFFFAOYSA-N Google Search
Mol Weight	533.1 g/mol
Molecular Formula	C31H33ClN2O2S
Exact Mass	532.195127 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	ANAoOqHlsMZ
Name	2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-3-(cyclohexylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
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/C31H33ClN2O2S/c32-24-14-12-22(13-15-24)26(35)20-37-30-33-28-25-11-5-4-10-23(25)18-31(16-6-7-17-31)27(28)29(36)34(30)19-21-8-2-1-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey	VNSQUGRUINKNPD-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_7207
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/12238514