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[(E)-2-chloranylhept-2-enyl]sulfinylbenzene
SpectraBase Compound ID DRcPyv4m9gv
InChI InChI=1S/C13H17ClOS/c1-2-3-5-8-12(14)11-16(15)13-9-6-4-7-10-13/h4,6-10H,2-3,5,11H2,1H3/b12-8+
InChIKey OZGJJKCNUHYHTA-XYOKQWHBSA-N
Mol Weight 256.79 g/mol
Molecular Formula C13H17ClOS
Exact Mass 256.068864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWxcQ8PPqjQ
Name [(E)-2-chloranylhept-2-enyl]sulfinylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C13H17ClOS
InChI InChI=1S/C13H17ClOS/c1-2-3-5-8-12(14)11-16(15)13-9-6-4-7-10-13/h4,6-10H,2-3,5,11H2,1H3/b12-8+
InChIKey OZGJJKCNUHYHTA-XYOKQWHBSA-N
Molecular Weight 256.791 g/mol
SMILES C(S(=O)c1ccccc1)\C(=C/CCCC)Cl
SPLASH splash10-004i-0900000000-e5cf01d338bcc1a761a8
Source of Spectrum K1-2000-1942-0
Synonyms [(E)-2-chlorohept-2-enyl]sulfinylbenzene
Wiley ID 750228