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(E)-1-Chloro-2-methyl-1-(p-tolylsulfinyl)-1,3-butadiene
SpectraBase Compound ID KYGCjqXjKke
InChI InChI=1S/C12H13ClOS/c1-4-10(3)12(13)15(14)11-7-5-9(2)6-8-11/h4-8H,1H2,2-3H3/b12-10-
InChIKey XNSDIHYNWBYEET-BENRWUELSA-N
Mol Weight 240.75 g/mol
Molecular Formula C12H13ClOS
Exact Mass 240.037564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3s456h9EiOP
Name (E)-1-Chloro-2-methyl-1-(p-tolylsulfinyl)-1,3-butadiene
Alternate Name(s) (1E)-1-chloro-2-methyl-1,3-butadienyl 4-methylphenyl sulfoxide (E)-1-Chloro-2-methyl-1-(p-tolylsulfonyl)-1,3-butadiene 1-{[(1E)-1-chloro-2-methyl-1,3-butadienyl]sulfinyl}-4-methylbenzene
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Formula C12H13ClOS
InChI InChI=1S/C12H13ClOS/c1-4-10(3)12(13)15(14)11-7-5-9(2)6-8-11/h4-8H,1H2,2-3H3/b12-10-
InChIKey XNSDIHYNWBYEET-BENRWUELSA-N
Molecular Weight 240.748 g/mol
SMILES c1(S(\C(=C/(C=C)C)Cl)=O)ccc(cc1)C
SPLASH splash10-014r-7920000000-aec3ce23582c46c9e1a7
Source of Spectrum KC-61-10273-13
Wiley ID 1630944