3-(2-methylallyl)-2-(propylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

SpectraBase Compound ID	IDlhRYZqb1g
InChI	InChI=1S/C23H28N2OS/c1-4-13-27-22-24-20-18-10-6-5-9-17(18)14-23(11-7-8-12-23)19(20)21(26)25(22)15-16(2)3/h5-6,9-10H,2,4,7-8,11-15H2,1,3H3
InChIKey	RATDIGYLDHZURB-UHFFFAOYSA-N Google Search
Mol Weight	380.55 g/mol
Molecular Formula	C23H28N2OS
Exact Mass	380.192235 g/mol

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SpectraBase Spectrum ID	Dxa1AtzkKIN
Name	3-(2-methylallyl)-2-(propylthio)-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/C23H28N2OS/c1-4-13-27-22-24-20-18-10-6-5-9-17(18)14-23(11-7-8-12-23)19(20)21(26)25(22)15-16(2)3/h5-6,9-10H,2,4,7-8,11-15H2,1,3H3
InChIKey	RATDIGYLDHZURB-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_7243
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/12238570