2-(methylthio)-3-(p-tolyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

SpectraBase Compound ID	5eI7KzbwDJb
InChI	InChI=1S/C25H26N2OS/c1-17-10-12-19(13-11-17)27-23(28)21-22(26-24(27)29-2)20-9-5-4-8-18(20)16-25(21)14-6-3-7-15-25/h4-5,8-13H,3,6-7,14-16H2,1-2H3
InChIKey	QCZNPFNCBDJERF-UHFFFAOYSA-N Google Search
Mol Weight	402.56 g/mol
Molecular Formula	C25H26N2OS
Exact Mass	402.176585 g/mol

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SpectraBase Spectrum ID	8RAosVMMg2j
Name	2-(methylthio)-3-(p-tolyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-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/C25H26N2OS/c1-17-10-12-19(13-11-17)27-23(28)21-22(26-24(27)29-2)20-9-5-4-8-18(20)16-25(21)14-6-3-7-15-25/h4-5,8-13H,3,6-7,14-16H2,1-2H3
InChIKey	QCZNPFNCBDJERF-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_7577
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/10329360