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6-(Trifluoroacetoxy)-7-chloro-2-methylbenz[b]oxepine-3,5-(2H,4H)-dione
SpectraBase Compound ID KICMgdkwvmH
InChI InChI=1S/C13H8ClF3O5/c1-5-9(18)11(22-12(20)13(15,16)17)10(19)7-4-6(14)2-3-8(7)21-5/h2-5,11H,1H3
InChIKey YOURQFMDHLHNPI-UHFFFAOYSA-N
Mol Weight 336.65 g/mol
Molecular Formula C13H8ClF3O5
Exact Mass 336.001236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ge0dtTbJ8Tn
Name 6-(Trifluoroacetoxy)-7-chloro-2-methylbenz[b]oxepine-3,5-(2H,4H)-dione
Alternate Name(s) 4-(Trifluoroacetoxy)-7-chloro-2-methylbenz[b]oxepine-3,5-(2H,4H)-dione 7-Chloro-2-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1-benzoxepin-6-yl trifluoroacetate
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Formula C13H8ClF3O5
InChI InChI=1S/C13H8ClF3O5/c1-5-9(18)11(22-12(20)13(15,16)17)10(19)7-4-6(14)2-3-8(7)21-5/h2-5,11H,1H3
InChIKey YOURQFMDHLHNPI-UHFFFAOYSA-N
Molecular Weight 336.650 g/mol
SMILES C1(C(c2c(ccc(c2)Cl)OC(C1=O)C)=O)OC(C(F)(F)F)=O
SPLASH splash10-0a4i-1910000000-39cbfd27f8aae377a367
Source of Spectrum J-58-4888-4
Wiley ID 1332021