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7-(Phenylthio)-1,4-dioxaspiro[4.4]nonane
SpectraBase Compound ID 6vmZFDokWao
InChI InChI=1S/C13H16O2S/c1-2-4-11(5-3-1)16-12-6-7-13(10-12)14-8-9-15-13/h1-5,12H,6-10H2
InChIKey JXCPOKQKLKMMNF-UHFFFAOYSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBExkRL8qtZ
Name 7-(Phenylthio)-1,4-dioxaspiro[4.4]nonane
Alternate Name(s) 1,4-Dioxaspiro[4.4]non-7-yl phenyl sulfide 7-(Phenylsulfanyl)-1,4-dioxaspiro[4.4]nonane
CAS Registry Number 96227-51-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-2-4-11(5-3-1)16-12-6-7-13(10-12)14-8-9-15-13/h1-5,12H,6-10H2
InChIKey JXCPOKQKLKMMNF-UHFFFAOYSA-N
Molecular Weight 236.329 g/mol
SMILES C12(CC(Sc3ccccc3)CC1)OCCO2
SPLASH splash10-0a6r-9500000000-206253f7df2705a82413
Source of Spectrum J-50-2571-0
Wiley ID 1237969