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(S)-tert-Butyl N-(2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenylpropyl)carbamate
SpectraBase Compound ID 9abBPfld5AO
InChI InChI=1S/C20H20F3NO3/c1-19(2,3)27-18(26)24-16(13-9-11-15(21)12-10-13)20(22,23)17(25)14-7-5-4-6-8-14/h4-12,16H,1-3H3,(H,24,26)/t16-/m0/s1
InChIKey BSPQGCUGMWHASE-INIZCTEOSA-N
Mol Weight 379.38 g/mol
Molecular Formula C20H20F3NO3
Exact Mass 379.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COtnPfQ5dTv
Name (S)-tert-Butyl N-(2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenylpropyl)carbamate
Alternate Name(s) (S)-tert-butyl (2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenylpropyl)carbamate N-[(1S)-2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenylpropyl]carbamic acid tert-butyl ester tert-Butyl N-[(1S)-2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenylpropyl]carbamate tert-Butyl N-[(1S)-2,2-difluoro-1-(4-fluorophenyl)-3-oxo-3-phenyl-propyl]carbamate tert-Butyl N-[(1S)-2,2-bis(fluoranyl)-1-(4-fluorophenyl)-3-oxidanylidene-3-phenyl-propyl]carbamate
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Formula C20H20F3NO3
InChI InChI=1S/C20H20F3NO3/c1-19(2,3)27-18(26)24-16(13-9-11-15(21)12-10-13)20(22,23)17(25)14-7-5-4-6-8-14/h4-12,16H,1-3H3,(H,24,26)/t16-/m0/s1
InChIKey BSPQGCUGMWHASE-INIZCTEOSA-N
Literature Reference DOI 10.1021/ol200374m
Molecular Weight 379.379 g/mol
SMILES N([C@@](c1ccc(cc1)F)(C(F)(C(c1ccccc1)=O)F)[H])C(=O)OC(C)(C)C
SPLASH splash10-0avi-4910000000-82722f16fb11d316f392
Source of Spectrum A1-13-1860/SMS12-6g
Wiley ID 1753096