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4-[2-(4-fluoro-2,7-dimethyl-1H-indol-3-yl)ethylcarbamoyl]benzoic acid methyl ester
SpectraBase Compound ID 8vzbIxut5V4
InChI InChI=1S/C21H21FN2O3/c1-12-4-9-17(22)18-16(13(2)24-19(12)18)10-11-23-20(25)14-5-7-15(8-6-14)21(26)27-3/h4-9,24H,10-11H2,1-3H3,(H,23,25)
InChIKey IGRYTYLFEVLZJI-UHFFFAOYSA-N
Mol Weight 368.41 g/mol
Molecular Formula C21H21FN2O3
Exact Mass 368.153621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYbwsQGfqLs
Name 4-[2-(4-fluoro-2,7-dimethyl-1H-indol-3-yl)ethylcarbamoyl]benzoic acid methyl ester
Alternate Name(s) 4-[[2-(4-fluoro-2,7-dimethyl-1H-indol-3-yl)ethylamino]-oxomethyl]benzoic acid methyl ester Methyl 4-[2-(4-fluoranyl-2,7-dimethyl-1H-indol-3-yl)ethylcarbamoyl]benzoate Methyl 4-[2-(4-fluoro-2,7-dimethyl-1H-indol-3-yl)ethylcarbamoyl]benzoate
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Formula C21H21FN2O3
InChI InChI=1S/C21H21FN2O3/c1-12-4-9-17(22)18-16(13(2)24-19(12)18)10-11-23-20(25)14-5-7-15(8-6-14)21(26)27-3/h4-9,24H,10-11H2,1-3H3,(H,23,25)
InChIKey IGRYTYLFEVLZJI-UHFFFAOYSA-N
Molecular Weight 368.408 g/mol
SMILES N(C(c1ccc(C(=O)OC)cc1)=O)CCc1c2c([nH]c1C)c(ccc2F)C
SPLASH splash10-004i-1900000000-b3f4c5a4bce11b2e76e9
Wiley ID 1452643