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Dimethyl 9,10-Di(hex-5'-enyl)-4H,5H,9H,10H-cycloocta[1,2-b:6,5-b']dithiophene-2,7-dicarboxylate
SpectraBase Compound ID BWu5CeaeMA6
InChI InChI=1S/C28H36O4S2/c1-5-7-9-11-13-21-22(14-12-10-8-6-2)26-20(18-24(34-26)28(30)32-4)16-15-19-17-23(27(29)31-3)33-25(19)21/h5-6,17-18,21-22H,1-2,7-16H2,3-4H3
InChIKey FQSPSXFGGMTEPI-UHFFFAOYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C28H36O4S2
Exact Mass 500.205502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 635HUGvTN1P
Name Dimethyl 9,10-Di(hex-5'-enyl)-4H,5H,9H,10H-cycloocta[1,2-b:6,5-b']dithiophene-2,7-dicarboxylate
Alternate Name(s) Dimethyl 9,10-di(5-hexenyl)-4,5,9,10-tetrahydrothieno[3',2':5,6]cycloocta[1,2-b]thiophene-2,7-dicarboxylate
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Formula C28H36O4S2
InChI InChI=1S/C28H36O4S2/c1-5-7-9-11-13-21-22(14-12-10-8-6-2)26-20(18-24(34-26)28(30)32-4)16-15-19-17-23(27(29)31-3)33-25(19)21/h5-6,17-18,21-22H,1-2,7-16H2,3-4H3
InChIKey FQSPSXFGGMTEPI-UHFFFAOYSA-N
Molecular Weight 500.712 g/mol
SMILES c12sc(C(=O)OC)cc2CCc2c(C(C1CCCCC=C)CCCCC=C)sc(C(=O)OC)c2
SPLASH splash10-05mo-2940700000-7a8901ef13498f7a98e6
Source of Spectrum F-48-8114-30
Wiley ID 1398881