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18-Bromo-3,10-dithia-tricyclo[12.2.2.2*5,8*]icosa-1(17),5(20),6,8(19),14(18),15-hexaene
SpectraBase Compound ID K66wKDj4FJX
InChI InChI=1S/C18H19BrS2/c19-18-10-16-7-8-17(18)2-1-9-20-11-14-3-5-15(6-4-14)12-21-13-16/h3-8,10H,1-2,9,11-13H2
InChIKey XPNDSAFHFDAIFE-UHFFFAOYSA-N
Mol Weight 379.37 g/mol
Molecular Formula C18H19BrS2
Exact Mass 378.011156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEtLop2O3tS
Name 18-Bromo-3,10-dithia-tricyclo[12.2.2.2*5,8*]icosa-1(17),5(20),6,8(19),14(18),15-hexaene
Alternate Name(s) 7-Bromo-2,13-dithia[5.3]paracyclophane
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Formula C18H19BrS2
InChI InChI=1S/C18H19BrS2/c19-18-10-16-7-8-17(18)2-1-9-20-11-14-3-5-15(6-4-14)12-21-13-16/h3-8,10H,1-2,9,11-13H2
InChIKey XPNDSAFHFDAIFE-UHFFFAOYSA-N
Molecular Weight 379.374 g/mol
SMILES c1(c2ccc(c1)CSCc1ccc(CSCCC2)cc1)Br
SPLASH splash10-06r5-2950000000-3e3f69a5d8e4a73065f6
Source of Spectrum U1-2009-232-23b
Wiley ID 1662399