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7-(3-(Phenylthio)propyl)-1,4-dioxaspiro[4.4]nonane
SpectraBase Compound ID 9P7wFkaYxjX
InChI InChI=1S/C16H22O2S/c1-2-6-15(7-3-1)19-12-4-5-14-8-9-16(13-14)17-10-11-18-16/h1-3,6-7,14H,4-5,8-13H2
InChIKey YVNSOALOBIWJPQ-UHFFFAOYSA-N
Mol Weight 278.41 g/mol
Molecular Formula C16H22O2S
Exact Mass 278.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SetBIRCwS
Name 7-(3-(Phenylthio)propyl)-1,4-dioxaspiro[4.4]nonane
Alternate Name(s) 3-(1,4-dioxaspiro[4.4]non-7-yl)propyl phenyl sulfide 7-[3-(phenylsulfanyl)propyl]-1,4-dioxaspiro[4.4]nonane
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Formula C16H22O2S
InChI InChI=1S/C16H22O2S/c1-2-6-15(7-3-1)19-12-4-5-14-8-9-16(13-14)17-10-11-18-16/h1-3,6-7,14H,4-5,8-13H2
InChIKey YVNSOALOBIWJPQ-UHFFFAOYSA-N
Molecular Weight 278.410 g/mol
SMILES C12(OCCO2)CC(CCCSc2ccccc2)CC1
SPLASH splash10-004j-7910000000-e2cf6a1c79bbef16f9be
Source of Spectrum F-53-17617-18
Wiley ID 805065