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trans-3-Iodo-6-bromo-1-methyl-4-phenyl-8-(2,2,2-trifluoroethoxy)-1-azaspiro[4.5]deca-3,6,9-trien-2-one
SpectraBase Compound ID HdtPAS9Bkdb
InChI InChI=1S/C18H14BrF3INO2/c1-24-16(25)15(23)14(11-5-3-2-4-6-11)17(24)8-7-12(9-13(17)19)26-10-18(20,21)22/h2-9,12H,10H2,1H3/t12?,17-/m1/s1
InChIKey IUDSWGKXDGEGKN-RGUGMKFQSA-N
Mol Weight 540.12 g/mol
Molecular Formula C18H14BrF3INO2
Exact Mass 538.920471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IB2dYAwUKL3
Name trans-3-Iodo-6-bromo-1-methyl-4-phenyl-8-(2,2,2-trifluoroethoxy)-1-azaspiro[4.5]deca-3,6,9-trien-2-one
Alternate Name(s) cis-3-Iodo-6-bromo-1-methyl-4-phenyl-8-(2,2,2-trifluoroethoxy)-1-azaspiro[4.5]deca-3,6,9-trien-2-one
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Formula C18H14BrF3INO2
InChI InChI=1S/C18H14BrF3INO2/c1-24-16(25)15(23)14(11-5-3-2-4-6-11)17(24)8-7-12(9-13(17)19)26-10-18(20,21)22/h2-9,12H,10H2,1H3/t12?,17-/m1/s1
InChIKey IUDSWGKXDGEGKN-RGUGMKFQSA-N
Molecular Weight 540.119 g/mol
SMILES [C@]12(C(=C(I)C(N2C)=O)c2ccccc2)C(=CC(C=C1)OCC(F)(F)F)Br
SPLASH splash10-01u0-0907620000-6da775a0e2db223bfa68
Source of Spectrum F4-41-897-3ka-c
Wiley ID 1672110