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2-[(1,1-Dimethylethyl)amino]-2-oxo-1-(quinolin-4-yl)ethyl 4-Fluorobenzoate
SpectraBase Compound ID D8JpMdrS5Yx
InChI InChI=1S/C22H21FN2O3/c1-22(2,3)25-20(26)19(28-21(27)14-8-10-15(23)11-9-14)17-12-13-24-18-7-5-4-6-16(17)18/h4-13,19H,1-3H3,(H,25,26)
InChIKey HSOCVPWAUZURSQ-UHFFFAOYSA-N
Mol Weight 380.42 g/mol
Molecular Formula C22H21FN2O3
Exact Mass 380.153621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3uPMOoqEYH
Name 2-[(1,1-Dimethylethyl)amino]-2-oxo-1-(quinolin-4-yl)ethyl 4-Fluorobenzoate
Alternate Name(s) 2-(tert-butylamino)-2-oxo-1-(quinolin-4-yl)ethyl 4-fluorobenzoate
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Formula C22H21FN2O3
InChI InChI=1S/C22H21FN2O3/c1-22(2,3)25-20(26)19(28-21(27)14-8-10-15(23)11-9-14)17-12-13-24-18-7-5-4-6-16(17)18/h4-13,19H,1-3H3,(H,25,26)
InChIKey HSOCVPWAUZURSQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201300378
Molecular Weight 380.419 g/mol
SMILES N(C(C)(C)C)C(C(OC(c1ccc(cc1)F)=O)c1c2ccccc2ncc1)=O
SPLASH splash10-0a4i-5910000000-dfba528595593e881731
Source of Spectrum H-97-1094-4o
Wiley ID 1784997