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Cyclohexanecarboxylic acid, 2-[[[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]amino]carbonyl]-, 2,2,2-trifluoroethyl ester
SpectraBase Compound ID IHt8I8F6U78
InChI InChI=1S/C21H24F4N2O3/c1-12-13(14-7-4-8-17(22)18(14)27-12)9-10-26-19(28)15-5-2-3-6-16(15)20(29)30-11-21(23,24)25/h4,7-8,15-16,27H,2-3,5-6,9-11H2,1H3,(H,26,28)
InChIKey WVASHTRQOJJJRO-UHFFFAOYSA-N
Mol Weight 428.43 g/mol
Molecular Formula C21H24F4N2O3
Exact Mass 428.172305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZ4Httr3dIJ
Name Cyclohexanecarboxylic acid, 2-[[[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]amino]carbonyl]-, 2,2,2-trifluoroethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24F4N2O3
InChI InChI=1S/C21H24F4N2O3/c1-12-13(14-7-4-8-17(22)18(14)27-12)9-10-26-19(28)15-5-2-3-6-16(15)20(29)30-11-21(23,24)25/h4,7-8,15-16,27H,2-3,5-6,9-11H2,1H3,(H,26,28)
InChIKey WVASHTRQOJJJRO-UHFFFAOYSA-N
Molecular Weight 428.428 g/mol
SMILES N(C(=O)C1C(CCCC1)C(OCC(F)(F)F)=O)CCc1c([nH]c2c1cccc2F)C
SPLASH splash10-01t9-2900000000-6171f57a0c457c1e6e9f
Source of Spectrum IY-1-4691-7
Synonyms 2-[[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester 2,2,2-trifluoroethyl 2-[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylate 2,2,2-trifluoroethyl 2-[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexanecarboxylate 2,2,2-tris(fluoranyl)ethyl 2-[2-(7-fluoranyl-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylate
Wiley ID 1654900