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3,5-Dimethoxy-2,2-dimethyl-6-(4-methylphenyl)sulfanyl-hexanal
SpectraBase Compound ID 2CtVwJYBojx
InChI InChI=1S/C17H26O3S/c1-13-6-8-15(9-7-13)21-11-14(19-4)10-16(20-5)17(2,3)12-18/h6-9,12,14,16H,10-11H2,1-5H3
InChIKey ZNSXATJEDUEZDG-UHFFFAOYSA-N
Mol Weight 310.45 g/mol
Molecular Formula C17H26O3S
Exact Mass 310.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qX9T4ClWfE
Name 3,5-Dimethoxy-2,2-dimethyl-6-(4-methylphenyl)sulfanyl-hexanal
Alternate Name(s) 3,5-Dimethoxy-2,2-dimethyl-6-(p-tolylsulfanyl)hexanal 3,5-Dimethoxy-2,2-dimethyl-6-(p-tolylthio)hexanal 3,5-Dimethoxy-2,2-dimethyl-6-[(4-methylphenyl)thio]hexanal
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Formula C17H26O3S
InChI InChI=1S/C17H26O3S/c1-13-6-8-15(9-7-13)21-11-14(19-4)10-16(20-5)17(2,3)12-18/h6-9,12,14,16H,10-11H2,1-5H3
InChIKey ZNSXATJEDUEZDG-UHFFFAOYSA-N
Molecular Weight 310.452 g/mol
SMILES C(C(CC(CSc1ccc(cc1)C)OC)OC)(C=O)(C)C
SPLASH splash10-000m-4901000000-70014b994134df45da40
Source of Spectrum QF-47-900-10
Wiley ID 833756