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Ethyl 6-chloro-4'-(pivaloyloxy)biphenyl-2-carboxylate
SpectraBase Compound ID Knv98LiWMLt
InChI InChI=1S/C20H21ClO4/c1-5-24-18(22)15-7-6-8-16(21)17(15)13-9-11-14(12-10-13)25-19(23)20(2,3)4/h6-12H,5H2,1-4H3
InChIKey RFAOUGBSVCGXQK-UHFFFAOYSA-N
Mol Weight 360.84 g/mol
Molecular Formula C20H21ClO4
Exact Mass 360.112837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9BQni9wLRn
Name Ethyl 6-chloro-4'-(pivaloyloxy)biphenyl-2-carboxylate
Alternate Name(s) Ethyl 6-chloro-4'-(pivaloyloxy)-[1,1'-biphenyl]-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21ClO4
InChI InChI=1S/C20H21ClO4/c1-5-24-18(22)15-7-6-8-16(21)17(15)13-9-11-14(12-10-13)25-19(23)20(2,3)4/h6-12H,5H2,1-4H3
InChIKey RFAOUGBSVCGXQK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201204526
Molecular Weight 360.837 g/mol
SMILES c1cc(C(OCC)=O)c(-c2ccc(cc2)OC(C(C)(C)C)=O)c(c1)Cl
SPLASH splash10-004r-3692000000-054e07177b74a4316fb2
Source of Spectrum ACI-51-SM15-6c
Wiley ID 1780655