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1,1'-[1",4"-Dioxobut-2"-ene-1",4"-diyl]-bis[1,4,5,6,7,7a-hexahydro-8,8-dimethyl-3H-3a,6-methano2.1]benzisothiazole]-2,2,2',2-tetraoxide
SpectraBase Compound ID 4NeHirN4KpJ
InChI InChI=1S/C24H34N2O6S2/c1-21(2)15-7-9-23(21)13-33(29,30)25(17(23)11-15)19(27)5-6-20(28)26-18-12-16-8-10-24(18,22(16,3)4)14-34(26,31)32/h5-6,15-18H,7-14H2,1-4H3/b6-5+/t15-,16-,17?,18?,23-,24-/m0/s1
InChIKey KXYJHSCVAGWJNK-ZUIQCTQMSA-N
Mol Weight 510.7 g/mol
Molecular Formula C24H34N2O6S2
Exact Mass 510.185829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FS8LRTbGGO
Name 1,1'-[1",4"-Dioxobut-2"-ene-1",4"-diyl]-bis[1,4,5,6,7,7a-hexahydro-8,8-dimethyl-3H-3a,6-methano2.1]benzisothiazole]-2,2,2',2-tetraoxide
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Formula C24H34N2O6S2
InChI InChI=1S/C24H34N2O6S2/c1-21(2)15-7-9-23(21)13-33(29,30)25(17(23)11-15)19(27)5-6-20(28)26-18-12-16-8-10-24(18,22(16,3)4)14-34(26,31)32/h5-6,15-18H,7-14H2,1-4H3/b6-5+/t15-,16-,17?,18?,23-,24-/m0/s1
InChIKey KXYJHSCVAGWJNK-ZUIQCTQMSA-N
Molecular Weight 510.664 g/mol
SMILES C12N(S(C[C@]11C([C@](C2)(CC1)[H])(C)C)(=O)=O)C(\C=C\C(N1S(C[C@@]23C1C[C@](CC3)(C2(C)C)[H])(=O)=O)=O)=O
SPLASH splash10-0f80-4950000000-8e17f0b80efe494b4ef3
Source of Spectrum H-81-1272-1
Synonyms 1,1'-[1'',4''-Dioxobut-2''-ene-1'',4''-diyl]-bis[1,4,5,6,7,7a-hexahydro-8,8-dimethyl-3H-3a,6-methano2.1]benzisothiazole]-2,2,2',2-tetraoxide 4-[(2E)-4-(10,10-dimethyl-3,3-dioxido-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl)-4-oxo-2-butenoyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
Wiley ID 1400453