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15,16-Dimethyl-2,9-dimethylthia[2.2](1,3)(1,4)cyclophane
SpectraBase Compound ID 4e9CsdriKGS
InChI InChI=1S/C20H24S2/c1-13-14(2)16-9-8-15(13)11-19(21-3)17-6-5-7-18(10-17)20(12-16)22-4/h5-10,19-20H,11-12H2,1-4H3
InChIKey OEKWOAUUBJJLCI-UHFFFAOYSA-N
Mol Weight 328.53 g/mol
Molecular Formula C20H24S2
Exact Mass 328.131943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QTa3KYXwBM
Name 15,16-Dimethyl-2,9-dimethylthia[2.2](1,3)(1,4)cyclophane
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Formula C20H24S2
InChI InChI=1S/C20H24S2/c1-13-14(2)16-9-8-15(13)11-19(21-3)17-6-5-7-18(10-17)20(12-16)22-4/h5-10,19-20H,11-12H2,1-4H3
InChIKey OEKWOAUUBJJLCI-UHFFFAOYSA-N
Molecular Weight 328.532 g/mol
SMILES c1(c(c2CC(c3cccc(c3)C(Cc1cc2)SC)SC)C)C
SPLASH splash10-0002-0903000000-93332d27006f3ac5e128
Source of Spectrum KC-0-1376-16
Synonyms 12,13-dimethyl-3,9-bis(methylsulfanyl)tricyclo[9.2.2.1(4,8)]hexadeca-1(13),4(16),5,7,11,14-hexaene
Wiley ID 821225