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6-[(Trifluoromethanesulfonyl)oxy]-7,8-dihydrophenanthrene-1,4-dione
SpectraBase Compound ID DhEnpahRTPr
InChI InChI=1S/C15H9F3O5S/c16-15(17,18)24(21,22)23-9-3-1-8-2-4-10-12(19)5-6-13(20)14(10)11(8)7-9/h2,4-7H,1,3H2
InChIKey CQPLJJJROOAFDB-UHFFFAOYSA-N
Mol Weight 358.29 g/mol
Molecular Formula C15H9F3O5S
Exact Mass 358.012279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9j49mAoazy
Name 6-[(Trifluoromethanesulfonyl)oxy]-7,8-dihydrophenanthrene-1,4-dione
Alternate Name(s) 5,8-dioxo-1,2,5,8-tetrahydro-3-phenanthrenyl trifluoromethanesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C15H9F3O5S
InChI InChI=1S/C15H9F3O5S/c16-15(17,18)24(21,22)23-9-3-1-8-2-4-10-12(19)5-6-13(20)14(10)11(8)7-9/h2,4-7H,1,3H2
InChIKey CQPLJJJROOAFDB-UHFFFAOYSA-N
Molecular Weight 358.287 g/mol
SMILES C1(C=CC(c2c3C=C(CCc3ccc12)OS(=O)(=O)C(F)(F)F)=O)=O
SPLASH splash10-0002-0903000000-6c4eea399fe371917ee8
Source of Spectrum QF-9-4129-37
Wiley ID 1558829