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7-(Phenylsulfinyl)-1,4-dioxaspiro[4.4]nonane
SpectraBase Compound ID 4OgSmo7KvQi
InChI InChI=1S/C13H16O3S/c14-17(11-4-2-1-3-5-11)12-6-7-13(10-12)15-8-9-16-13/h1-5,12H,6-10H2
InChIKey YOCHCZCOEPFTRM-UHFFFAOYSA-N
Mol Weight 252.33 g/mol
Molecular Formula C13H16O3S
Exact Mass 252.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CECB3HH8xhs
Name 7-(Phenylsulfinyl)-1,4-dioxaspiro[4.4]nonane
CAS Registry Number 96227-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3S
InChI InChI=1S/C13H16O3S/c14-17(11-4-2-1-3-5-11)12-6-7-13(10-12)15-8-9-16-13/h1-5,12H,6-10H2
InChIKey YOCHCZCOEPFTRM-UHFFFAOYSA-N
Molecular Weight 252.328 g/mol
SMILES C1(S(=O)c2ccccc2)CC2(OCCO2)CC1
SPLASH splash10-056r-9700000000-d125e5bc0637549ebfe6
Source of Spectrum J-50-2572-13
Synonyms 1,4-Dioxaspiro[4.4]non-7-yl phenyl sulfoxide
Wiley ID 1255315