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syn-6-tert-Butyl-9,18-dimethoxy-2,11-dithia[3.3]metacyclophane
SpectraBase Compound ID 6vALxyP5JhH
InChI InChI=1S/C22H28O2S2/c1-22(2,3)19-9-17-13-25-11-15-7-6-8-16(20(15)23-4)12-26-14-18(10-19)21(17)24-5/h6-10H,11-14H2,1-5H3
InChIKey NMIIBNOYTUTICR-UHFFFAOYSA-N
Mol Weight 388.58 g/mol
Molecular Formula C22H28O2S2
Exact Mass 388.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nWwVQjKbJq
Name syn-6-tert-Butyl-9,18-dimethoxy-2,11-dithia[3.3]metacyclophane
Alternate Name(s) anti-6-tert-Butyl-9,18-dimethoxy-2,11-dithia[3.3]metacyclophane 7-tert-Butyl-17,18-dimethoxy-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),5(18),6,8,13,15-hexaene
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Formula C22H28O2S2
InChI InChI=1S/C22H28O2S2/c1-22(2,3)19-9-17-13-25-11-15-7-6-8-16(20(15)23-4)12-26-14-18(10-19)21(17)24-5/h6-10H,11-14H2,1-5H3
InChIKey NMIIBNOYTUTICR-UHFFFAOYSA-N
Molecular Weight 388.584 g/mol
SMILES c12c(c(CSCc3c(c(CSC2)ccc3)OC)cc(c1)C(C)(C)C)OC
SPLASH splash10-009l-0956000000-5a87c8273b73c48c010e
Source of Spectrum J-62-6483-27
Wiley ID 1363840