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1-(RS)-3-(RS)-.alpha.(RS)-.Alpha-(9-Anthracenyl)-1,3-dioxo-1,3-dithiane-2-methanol
SpectraBase Compound ID C6Lp3o96tyA
InChI InChI=1S/C19H20O3S2/c20-18(19-23(21)9-4-10-24(19)22)16-8-3-7-15-11-13-5-1-2-6-14(13)12-17(15)16/h1-3,5-8,11-12,18-22H,4,9-10H2/t18-/m1/s1
InChIKey GUGYHRDJMIQJOV-GOSISDBHSA-N
Mol Weight 362.5 g/mol
Molecular Formula C19H22O3S2
Exact Mass 362.101037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cvGJ4kq2nP
Name 1-(RS)-3-(RS)-.alpha.(RS)-.Alpha-(9-Anthracenyl)-1,3-dioxo-1,3-dithiane-2-methanol
Alternate Name(s) 1-(RS)-3-(RS)-.alpha.(RS)-..alpha.-(9-Anthracenyl)-1,3-dioxo-1,3-dithiane-2-methanol 1-(RS)-3-(RS)-.alpha.-(RS)-.alpha.-(9-Anthracenyl)-1,3-dioxo-1,3-dithiane-2-methanol
Comments Note: The molecular formula of the structure shown is C19H20O3S2 - which differs from the formula reported for the mass spectrum (C19H18O3S2)
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Formula C19H18O3S2
InChI InChI=1S/C19H20O3S2/c20-18(19-23(21)9-4-10-24(19)22)16-8-3-7-15-11-13-5-1-2-6-14(13)12-17(15)16/h1-3,5-8,11-12,18-22H,4,9-10H2/t18-/m1/s1
InChIKey GUGYHRDJMIQJOV-GOSISDBHSA-N
Molecular Weight 362.502 g/mol
SMILES O[C@@](C1S(CCCS1O)O)(c1c2cc3ccccc3cc2ccc1)[H]
SPLASH splash10-06z1-5902000000-88b494d950e7c331290f
Source of Spectrum J-60-2180-7
Wiley ID 1346952