3-HYDROXY-3-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-PROPYL-BENZOATE

SpectraBase Compound ID	HxpWrt6pN2R
InChI	InChI=1S/C22H26O3S/c23-20(14-17-25-21(24)18-10-4-1-5-11-18)22(15-8-3-9-16-22)26-19-12-6-2-7-13-19/h1-2,4-7,10-13,20,23H,3,8-9,14-17H2
InChIKey	CRDQWYWLTPJZOS-UHFFFAOYSA-N Google Search
Mol Weight	370.51 g/mol
Molecular Formula	C22H26O3S
Exact Mass	370.160266 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	6aBNAfR2sb6
Name	3-Hydroxy-3-[1'-(phenylsulfayl)cyclohexyl]propyl benzoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H26O3S
InChI	InChI=1S/C22H26O3S/c23-20(14-17-25-21(24)18-10-4-1-5-11-18)22(15-8-3-9-16-22)26-19-12-6-2-7-13-19/h1-2,4-7,10-13,20,23H,3,8-9,14-17H2
InChIKey	CRDQWYWLTPJZOS-UHFFFAOYSA-N
Molecular Weight	370.507 g/mol
SMILES	OC(C1(Sc2ccccc2)CCCCC1)CCOC(=O)c1ccccc1
SPLASH	splash10-05fr-2902000000-7d4a54dd3ca4f100aacb
Source of Spectrum	KC-0-2778-31
Synonyms	[3-hydroxy-3-(1-phenylsulfanylcyclohexyl)propyl] benzoate [3-oxidanyl-3-(1-phenylsulfanylcyclohexyl)propyl] benzoate
Wiley ID	829099