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Isoindole-1,3-dione, 2-[4-(5-chlorobenzooxazol-2-yl)phenyl]-
SpectraBase Compound ID FZ3UsBoRB2r
InChI InChI=1S/C21H11ClN2O3/c22-13-7-10-18-17(11-13)23-19(27-18)12-5-8-14(9-6-12)24-20(25)15-3-1-2-4-16(15)21(24)26/h1-11H
InChIKey UFWBTMUIQMWIEM-UHFFFAOYSA-N
Mol Weight 374.78 g/mol
Molecular Formula C21H11ClN2O3
Exact Mass 374.04582 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6jcfWHeAK8
Name Isoindole-1,3-dione, 2-[4-(5-chlorobenzooxazol-2-yl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.045819919 u
Formula C21H11ClN2O3
InChI InChI=1S/C21H11ClN2O3/c22-13-7-10-18-17(11-13)23-19(27-18)12-5-8-14(9-6-12)24-20(25)15-3-1-2-4-16(15)21(24)26/h1-11H
InChIKey UFWBTMUIQMWIEM-UHFFFAOYSA-N
Molecular Weight 374.783 g/mol
SMILES C1=CC=2C(N(C(=O)C2C=C1)C1=CC=C(C2=NC3=CC(Cl)=CC=C3O2)C=C1)=O