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1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid 1,1-di(trifluoromethyl)methyl ester
SpectraBase Compound ID 9F6mAAF5XrD
InChI InChI=1S/C22H16ClF6NO4/c1-11-15(10-18(31)34-20(21(24,25)26)22(27,28)29)16-9-14(33-2)7-8-17(16)30(11)19(32)12-3-5-13(23)6-4-12/h3-9,20H,10H2,1-2H3
InChIKey OSOLVVZEGZKNTM-UHFFFAOYSA-N
Mol Weight 507.82 g/mol
Molecular Formula C22H16ClF6NO4
Exact Mass 507.067205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Al0WVyANq6x
Name 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid 1,1-di(trifluoromethyl)methyl ester
Alternate Name(s) 1-(4-Chlorobenzoyl)-2-methyl-5-methoxyindole-3-acetic acid 1,1-di(trifluoromethylmethyl) ester 2,2,2-trifluoro-1-(trifluoromethyl)ethyl[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate
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Formula C22H16ClF6NO4
InChI InChI=1S/C22H16ClF6NO4/c1-11-15(10-18(31)34-20(21(24,25)26)22(27,28)29)16-9-14(33-2)7-8-17(16)30(11)19(32)12-3-5-13(23)6-4-12/h3-9,20H,10H2,1-2H3
InChIKey OSOLVVZEGZKNTM-UHFFFAOYSA-N
Molecular Weight 507.816 g/mol
SMILES c1([n](c2c(c1CC(OC(C(F)(F)F)C(F)(F)F)=O)cc(cc2)OC)C(c1ccc(cc1)Cl)=O)C
SPLASH splash10-000i-0900010000-fdf867a0c781633b895b
Source of Spectrum CJ-1992-0-0
Wiley ID 1399997