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Germacrene a, 9-methylthio-
SpectraBase Compound ID KilvOGVMo9F
InChI InChI=1S/C16H26S/c1-12(2)15-10-9-13(3)7-6-8-14(4)11-16(15)17-5/h8-9,16H,6-7,10-11H2,1-5H3/b13-9+,14-8-
InChIKey GIPPJMKSYDIDGY-IXGQGZMGSA-N
Mol Weight 250.44 g/mol
Molecular Formula C16H26S
Exact Mass 250.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6X1yvq79DoD
Name Germacrene a, 9-methylthio-
Alternate Name(s) 1,5-Dimethyl-8-(1-methylethylidene)-9-(methylsulfanyl)-1,5-cyclodecadiene 3,7-Dimethyl-10-(1-methylethylidene)-3,7-cyclodecadien-1-yl methyl sulfide
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Formula C16H26S
InChI InChI=1S/C16H26S/c1-12(2)15-10-9-13(3)7-6-8-14(4)11-16(15)17-5/h8-9,16H,6-7,10-11H2,1-5H3/b13-9+,14-8-
InChIKey GIPPJMKSYDIDGY-IXGQGZMGSA-N
Molecular Weight 250.444 g/mol
SMILES C\C=1CC\C=C\(C)CC(SC)C(CC\1)=C(C)C
SPLASH splash10-05mx-9600000000-4f83eff3468ab35ab98a
Wiley ID 1475953