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2-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}hexahydro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID KTHji5RpGqL
InChI InChI=1S/C20H21F3N2O3/c1-11-13(16-10-12(28-20(21,22)23)6-7-17(16)24-11)8-9-25-18(26)14-4-2-3-5-15(14)19(25)27/h6-7,10,14-15,24H,2-5,8-9H2,1H3
InChIKey WXCNXXJXVZNBOY-UHFFFAOYSA-N
Mol Weight 394.39 g/mol
Molecular Formula C20H21F3N2O3
Exact Mass 394.150427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLWUNWvyvIG
Name 2-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}hexahydro-1H-isoindole-1,3(2H)-dione
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Formula C20H21F3N2O3
InChI InChI=1S/C20H21F3N2O3/c1-11-13(16-10-12(28-20(21,22)23)6-7-17(16)24-11)8-9-25-18(26)14-4-2-3-5-15(14)19(25)27/h6-7,10,14-15,24H,2-5,8-9H2,1H3
InChIKey WXCNXXJXVZNBOY-UHFFFAOYSA-N
Molecular Weight 394.394 g/mol
SMILES [nH]1c2c(c(c1C)CCN1C(C3CCCCC3C1=O)=O)cc(cc2)OC(F)(F)F
SPLASH splash10-004l-0191000000-0f3e779f8206a618121a
Synonyms 2-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 2-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone 2-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Hexahydroisoindole-1,3-dione, 2-[2-(2-methyl-5-trifluoromethoxy-1H-indol-3-yl)ethyl]-
Wiley ID 1441368