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O-[(Dibenzobicyclo[2.2.2]octadien-7-yl)-methyl] S-methyl xanthate
SpectraBase Compound ID 6Q8vOZTqX3k
InChI InChI=1S/C19H18OS2/c1-22-19(21)20-11-12-10-17-13-6-2-4-8-15(13)18(12)16-9-5-3-7-14(16)17/h2-9,12,17-18H,10-11H2,1H3/t12?,17-,18+
InChIKey LTSLAZXKVXHJBF-LBUFLUNBSA-N
Mol Weight 326.47 g/mol
Molecular Formula C19H18OS2
Exact Mass 326.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5aoPbmm9H3
Name O-[(Dibenzobicyclo[2.2.2]octadien-7-yl)-methyl] S-methyl xanthate
Alternate Name(s) S-methyl O-(tetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaen-15-ylmethyl) dithiocarbonate
CAS Registry Number 79593-54-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18OS2
InChI InChI=1S/C19H18OS2/c1-22-19(21)20-11-12-10-17-13-6-2-4-8-15(13)18(12)16-9-5-3-7-14(16)17/h2-9,12,17-18H,10-11H2,1H3/t12?,17-,18+
InChIKey LTSLAZXKVXHJBF-LBUFLUNBSA-N
Molecular Weight 326.472 g/mol
SMILES [C@]12(c3c(cccc3)[C@@](C(C1)COC(=S)SC)(c1c2cccc1)[H])[H]
SPLASH splash10-004i-0910000000-e7e284e8bb24d08b78fc
Source of Spectrum J-47-135-0
Wiley ID 1324824