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4,6-Dimethoxy-5,5-dimethyl-7-(4'-chlorophenylthio)hept-1-ene
SpectraBase Compound ID JPmb10w4Q8l
InChI InChI=1S/C17H25ClO2S/c1-6-7-15(19-4)17(2,3)16(20-5)12-21-14-10-8-13(18)9-11-14/h6,8-11,15-16H,1,7,12H2,2-5H3
InChIKey KPGPDVOGJGJLQU-UHFFFAOYSA-N
Mol Weight 328.9 g/mol
Molecular Formula C17H25ClO2S
Exact Mass 328.126379 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CiDkcX9jU
Name 4,6-Dimethoxy-5,5-dimethyl-7-(4'-chlorophenylthio)hept-1-ene
Alternate Name(s) 1-Chloro-4-[(2,4-dimethoxy-3,3-dimethyl-6-heptenyl)sulfanyl]benzene 1-Chloro-4-[(2,4-dimethoxy-3,3-dimethylhept-6-enyl)thio]benzene 1-Chloro-4-(2,4-dimethoxy-3,3-dimethylhept-6-enyl)sulfanylbenzene 1-Chloro-4-(2,4-dimethoxy-3,3-dimethyl-hept-6-enyl)sulfanyl-benzene 1-Chloranyl-4-(2,4-dimethoxy-3,3-dimethyl-hept-6-enyl)sulfanyl-benzene
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Formula C17H25ClO2S
InChI InChI=1S/C17H25ClO2S/c1-6-7-15(19-4)17(2,3)16(20-5)12-21-14-10-8-13(18)9-11-14/h6,8-11,15-16H,1,7,12H2,2-5H3
InChIKey KPGPDVOGJGJLQU-UHFFFAOYSA-N
Molecular Weight 328.898 g/mol
SMILES C(C(CSc1ccc(cc1)Cl)OC)(C(OC)CC=C)(C)C
SPLASH splash10-0fri-5950000000-7484a5fac44163a6de89
Source of Spectrum QF-47-901-25
Wiley ID 833748