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(Z)-5-(Phenylthio)-5-dodecen-7-yne
SpectraBase Compound ID 791x67kxOmp
InChI InChI=1S/C18H24S/c1-3-5-7-8-10-14-17(13-6-4-2)19-18-15-11-9-12-16-18/h9,11-12,14-16H,3-7,13H2,1-2H3/b17-14-
InChIKey FVBHCXZYWUCRCY-VKAVYKQESA-N
Mol Weight 272.45 g/mol
Molecular Formula C18H24S
Exact Mass 272.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CVA1pYQ3go
Name (Z)-5-(Phenylthio)-5-dodecen-7-yne
Alternate Name(s) (1Z)-1-butyl-1-octen-3-ynyl phenyl sulfide {[(1Z)-1-butyl-1-octen-3-ynyl]sulfanyl}benzene
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Formula C18H24S
InChI InChI=1S/C18H24S/c1-3-5-7-8-10-14-17(13-6-4-2)19-18-15-11-9-12-16-18/h9,11-12,14-16H,3-7,13H2,1-2H3/b17-14-
InChIKey FVBHCXZYWUCRCY-VKAVYKQESA-N
Molecular Weight 272.450 g/mol
SMILES C(#CCCCC)\C=C\(Sc1ccccc1)CCCC
SPLASH splash10-0f6x-9210000000-8f8611db7cc685c04e4a
Source of Spectrum C-115-7225-0
Wiley ID 1276630