2-[(1'-Phenylsulfanyl)cyclohexyl]butane-1,4-sulfite

SpectraBase Compound ID	Ayj4H8W9grg
InChI	InChI=1S/C16H22O3S2/c17-21-18-13-7-10-15(19-21)16(11-5-2-6-12-16)20-14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2
InChIKey	XWVFHTOCUQJPEU-UHFFFAOYSA-N Google Search
Mol Weight	326.47 g/mol
Molecular Formula	C16H22O3S2
Exact Mass	326.101037 g/mol

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SpectraBase Spectrum ID	4yjpNcooTyu
Name	2-[(1'-Phenylsulfanyl)cyclohexyl]butane-1,4-sulfite
Alternate Name(s)	1-[1'-(Phenylsulfanyl)cyclohexyl]-butane-1,4-sulfite 1-(2-oxido-1,3,2-dioxathiepan-4-yl)cyclohexyl phenyl sulfide 4-[1-(phenylsulfanyl)cyclohexyl]-1,3,2-dioxathiepane 2-oxide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H22O3S2
InChI	InChI=1S/C16H22O3S2/c17-21-18-13-7-10-15(19-21)16(11-5-2-6-12-16)20-14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2
InChIKey	XWVFHTOCUQJPEU-UHFFFAOYSA-N
Molecular Weight	326.469 g/mol
SMILES	C1(OS(OCCC1)=O)C1(Sc2ccccc2)CCCCC1
SPLASH	splash10-06r6-0940000000-f0def5c5a7ddbb6e8320
Source of Spectrum	D1-1999-1214-12
Wiley ID	835377