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(S)-Tert-butyl N-(2-(phenoxycarbonyl)-2,2-difluoro-1-phenylethyl)carbamate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(S)-Tert-butyl N-(2-(phenoxycarbonyl)-2,2-difluoro-1-phenylethyl)carbamate
SpectraBase Compound ID 3NCrofFE3IH
InChI InChI=1S/C20H21F2NO4/c1-19(2,3)27-18(25)23-16(14-10-6-4-7-11-14)20(21,22)17(24)26-15-12-8-5-9-13-15/h4-13,16H,1-3H3,(H,23,25)/t16-/m0/s1
InChIKey LVNKKNKSHWWGOV-INIZCTEOSA-N
Mol Weight 377.39 g/mol
Molecular Formula C20H21F2NO4
Exact Mass 377.143864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsZbtAbhT8X
Name (S)-Tert-butyl N-(2-(phenoxycarbonyl)-2,2-difluoro-1-phenylethyl)carbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.143864482 u
Formula C20H21F2NO4
InChI InChI=1S/C20H21F2NO4/c1-19(2,3)27-18(25)23-16(14-10-6-4-7-11-14)20(21,22)17(24)26-15-12-8-5-9-13-15/h4-13,16H,1-3H3,(H,23,25)/t16-/m0/s1
InChIKey LVNKKNKSHWWGOV-INIZCTEOSA-N
Molecular Weight 377.388 g/mol
SMILES C(F)([C@@](NC(=O)OC(C)(C)C)(C1=CC=CC=C1)[H])(F)C(=O)OC1=CC=CC=C1