Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
Allicin	539-86-6	65036

Structure

Other Information

Canonical SMILES	C=CCSS(=O)CC=C
Iso SMILES	C=CCSS(=O)CC=C
InChI	InChI=1S/C6H10OS2/c1-3-5-8-9(7)6-4-2/h3-4H,1-2,5-6H2
InChI Key	JDLKFOPOAOFWQN-UHFFFAOYSA-N
Formula	C6H10OS2
Mol Weight	162.273
XlogP3	1.3
Charge	0

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Synonyms Information

CAS Name	3-(prop-2-enylsulfinylthio)-1-propene
IUPAC Name	3-allylsulfinylsulfanylprop-1-ene
Openeye Name	3-prop-2-enylsulfinylsulfanylprop-1-ene
Systematic Name	3-prop-2-enylsulfinylsulfanylprop-1-ene
Tratitional Name	3-prop-2-enylsulfinylsulfanylprop-1-ene