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Ethyl 6-(tert-butoxycarbonyloxy)-4'-cyanobiphenyl-2-carboxylate
SpectraBase Compound ID 1hVmnWfzgvT
InChI InChI=1S/C21H21NO5/c1-5-25-19(23)16-7-6-8-17(26-20(24)27-21(2,3)4)18(16)15-11-9-14(13-22)10-12-15/h6-12H,5H2,1-4H3
InChIKey FWIYJIPXPRJITK-UHFFFAOYSA-N
Mol Weight 367.4 g/mol
Molecular Formula C21H21NO5
Exact Mass 367.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ebax3ukbGmC
Name Ethyl 6-(tert-butoxycarbonyloxy)-4'-cyanobiphenyl-2-carboxylate
Alternate Name(s) Ethyl 6-((tert-butoxycarbonyl)oxy)-4'-cyano-[1,1'-biphenyl]-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO5
InChI InChI=1S/C21H21NO5/c1-5-25-19(23)16-7-6-8-17(26-20(24)27-21(2,3)4)18(16)15-11-9-14(13-22)10-12-15/h6-12H,5H2,1-4H3
InChIKey FWIYJIPXPRJITK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201204526
Molecular Weight 367.401 g/mol
SMILES c1cc(C(OCC)=O)c(c(OC(=O)OC(C)(C)C)c1)-c1ccc(cc1)C#N
SPLASH splash10-066r-3090000000-2db7b413b983daf74496
Source of Spectrum ACI-51-SM16-6e
Wiley ID 1780657