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benzoic acid, 4-[[2,3-dihydro-1,3-dioxo-2-(2-pyridinyl)-1H-isoindol-5-yl]oxy]-
SpectraBase Compound ID 85Lo4LHjEVg
InChI InChI=1S/C20H12N2O5/c23-18-15-9-8-14(27-13-6-4-12(5-7-13)20(25)26)11-16(15)19(24)22(18)17-3-1-2-10-21-17/h1-11H,(H,25,26)
InChIKey JUXQWLBAUAJWSD-UHFFFAOYSA-N
Mol Weight 360.33 g/mol
Molecular Formula C20H12N2O5
Exact Mass 360.074621 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3OEHogKIHNW
Name Benzoic acid, 4-[[2,3-dihydro-1,3-dioxo-2-(2-pyridinyl)-1H-isoindol-5-yl]oxy]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.074621489 u
Formula C20H12N2O5
InChI InChI=1S/C20H12N2O5/c23-18-15-9-8-14(27-13-6-4-12(5-7-13)20(25)26)11-16(15)19(24)22(18)17-3-1-2-10-21-17/h1-11H,(H,25,26)
InChIKey JUXQWLBAUAJWSD-UHFFFAOYSA-N
Molecular Weight 360.325 g/mol
SMILES OC(C1=CC=C(OC2=CC=3C(N(C(C3C=C2)=O)C=2N=CC=CC2)=O)C=C1)=O