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[(1Z)-1-benzylideneoctyl]sulfanylbenzene
SpectraBase Compound ID IsNedvIhUwK
InChI InChI=1S/C21H26S/c1-2-3-4-5-10-17-21(18-19-13-8-6-9-14-19)22-20-15-11-7-12-16-20/h6-9,11-16,18H,2-5,10,17H2,1H3/b21-18-
InChIKey AFWLJFQLNPLBHU-UZYVYHOESA-N
Mol Weight 310.5 g/mol
Molecular Formula C21H26S
Exact Mass 310.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J1hq89gqCo
Name [(1Z)-1-benzylideneoctyl]sulfanylbenzene
Alternate Name(s) [(Z)-1-phenylnon-1-en-2-yl]sulfanylbenzene [[(Z)-1-heptyl-2-phenyl-vinyl]thio]benzene [[(Z)-1-phenylnon-1-en-2-yl]thio]benzene
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Formula C21H26S
InChI InChI=1S/C21H26S/c1-2-3-4-5-10-17-21(18-19-13-8-6-9-14-19)22-20-15-11-7-12-16-20/h6-9,11-16,18H,2-5,10,17H2,1H3/b21-18-
InChIKey AFWLJFQLNPLBHU-UZYVYHOESA-N
Molecular Weight 310.499 g/mol
SMILES c1(\C=C\(Sc2ccccc2)CCCCCCC)ccccc1
SPLASH splash10-03di-7829000000-1e0b71f341a06709c4fd
Source of Spectrum F7-15-62-4
Wiley ID 1556822