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Ethyl 2-[4-chlorophenyl]-7,8-benzocinchoninate

View entire compound with spectra: 1 NMR

Ethyl 2-[4-chlorophenyl]-7,8-benzocinchoninate
SpectraBase Compound ID 7InnNRnKcfz
InChI InChI=1S/C22H16ClNO2/c1-2-26-22(25)19-13-20(15-7-10-16(23)11-8-15)24-21-17-6-4-3-5-14(17)9-12-18(19)21/h3-13H,2H2,1H3
InChIKey MFLXBUNGNZBRNC-UHFFFAOYSA-N
Mol Weight 361.83 g/mol
Molecular Formula C22H16ClNO2
Exact Mass 361.086956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMXQHsh7Xbg
Name Ethyl 2-[4-chlorophenyl]-7,8-benzocinchoninate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.086956457 u
Formula C22H16ClNO2
InChI InChI=1S/C22H16ClNO2/c1-2-26-22(25)19-13-20(15-7-10-16(23)11-8-15)24-21-17-6-4-3-5-14(17)9-12-18(19)21/h3-13H,2H2,1H3
InChIKey MFLXBUNGNZBRNC-UHFFFAOYSA-N
Molecular Weight 361.828 g/mol
SMILES C1(Cl)=CC=C(C=C1)C=1C=C(C(=O)OCC)C2=C(N1)C1=C(C=CC=C1)C=C2