Cyclohexanone, 6-[(butylthio)methylene]-2,2-diphenyl-

SpectraBase Compound ID	Eebz8uti5bA
InChI	InChI=1S/C23H26OS/c1-2-3-17-25-18-19-11-10-16-23(22(19)24,20-12-6-4-7-13-20)21-14-8-5-9-15-21/h4-9,12-15,18H,2-3,10-11,16-17H2,1H3/b19-18+
InChIKey	DJPZTHCPTYZSHM-VHEBQXMUSA-N Google Search
Mol Weight	350.52 g/mol
Molecular Formula	C23H26OS
Exact Mass	350.170437 g/mol

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SpectraBase Spectrum ID	1o7HXEgGVrP
Name	Cyclohexanone, 6-[(butylthio)methylene]-2,2-diphenyl-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	350.170436630 u
Formula	C23H26OS
InChI	InChI=1S/C23H26OS/c1-2-3-17-25-18-19-11-10-16-23(22(19)24,20-12-6-4-7-13-20)21-14-8-5-9-15-21/h4-9,12-15,18H,2-3,10-11,16-17H2,1H3/b19-18+
InChIKey	DJPZTHCPTYZSHM-VHEBQXMUSA-N
Molecular Weight	350.520 g/mol
SMILES	CCCCS\C=C/1CCCC(C1=O)(C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.813634