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2,6-exo-8,12-endo-4-Phenylmethylene-3,5-dithiatetracyclo[5.5.1.0(2,6).0(8,12)]trideca-9-ene
SpectraBase Compound ID 8Gvde83i8Sy
InChI InChI=1S/C18H18S2/c1-2-5-11(6-3-1)9-16-19-17-14-10-15(18(17)20-16)13-8-4-7-12(13)14/h1-7,9,12-15,17-18H,8,10H2/b16-9+/t12-,13?,14+,15-,17+,18-/m1/s1
InChIKey RRCRJNIIMWWNSV-GGRXADIQSA-N
Mol Weight 298.46 g/mol
Molecular Formula C18H18S2
Exact Mass 298.084993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6ZqDZfEfbJ
Name 2,6-exo-8,12-endo-4-Phenylmethylene-3,5-dithiatetracyclo[5.5.1.0(2,6).0(8,12)]trideca-9-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18S2
InChI InChI=1S/C18H18S2/c1-2-5-11(6-3-1)9-16-19-17-14-10-15(18(17)20-16)13-8-4-7-12(13)14/h1-7,9,12-15,17-18H,8,10H2/b16-9+/t12-,13?,14+,15-,17+,18-/m1/s1
InChIKey RRCRJNIIMWWNSV-GGRXADIQSA-N
Molecular Weight 298.462 g/mol
SMILES [C@]12([C@]([C@]3(C[C@@]2(C2[C@]3(C=CC2)[H])[H])[H])(S\C(S1)=C/c1ccccc1)[H])[H]
SPLASH splash10-0006-9620000000-3c53060529269a5f99c1
Source of Spectrum F-53-2268-20
Synonyms (4Z)-4-benzylidene-3,5-dithiatetracyclo[5.5.1.0(2,6).0(8,12)]tridec-9-ene
Wiley ID 800586