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(Z)-1-chloranyl-1-(4-methylphenyl)sulfinyl-nonadec-10-en-2-one
SpectraBase Compound ID 5qelfXAA6Eh
InChI InChI=1S/C26H41ClO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(28)26(27)30(29)24-21-19-23(2)20-22-24/h10-11,19-22,26H,3-9,12-18H2,1-2H3/b11-10-
InChIKey UQVMPBVZIULLHL-KHPPLWFESA-N
Mol Weight 453.1 g/mol
Molecular Formula C26H41ClO2S
Exact Mass 452.251579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISisqHBkNIp
Name (Z)-1-chloranyl-1-(4-methylphenyl)sulfinyl-nonadec-10-en-2-one
Alternate Name(s) (Z)-1-chloro-1-(4-methylphenyl)sulfinyl-10-nonadecen-2-one (Z)-1-chloro-1-(4-methylphenyl)sulfinylnonadec-10-en-2-one (Z)-1-chloro-1-(p-tolylsulfinyl)nonadec-10-en-2-one
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Formula C26H41ClO2S
InChI InChI=1S/C26H41ClO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(28)26(27)30(29)24-21-19-23(2)20-22-24/h10-11,19-22,26H,3-9,12-18H2,1-2H3/b11-10-
InChIKey UQVMPBVZIULLHL-KHPPLWFESA-N
Molecular Weight 453.125 g/mol
SMILES C(S(c1ccc(cc1)C)=O)(C(=O)CCCCCCC\C=C/CCCCCCCC)Cl
SPLASH splash10-000i-0900000000-168917e1c398948bdcf3
Source of Spectrum F-51-9336-23
Wiley ID 793272