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o-Anisic acid, 3,4-dichlorophenyl ester
SpectraBase Compound ID Fhg2Br0Lnx5
InChI InChI=1S/C14H10Cl2O3/c1-18-13-5-3-2-4-10(13)14(17)19-9-6-7-11(15)12(16)8-9/h2-8H,1H3
InChIKey YFVNVFGDQAIOLM-UHFFFAOYSA-N
Mol Weight 297.14 g/mol
Molecular Formula C14H10Cl2O3
Exact Mass 296.0007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68esN58H4Di
Name o-Anisic acid, 3,4-dichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 296.000699579 u
Formula C14H10Cl2O3
InChI InChI=1S/C14H10Cl2O3/c1-18-13-5-3-2-4-10(13)14(17)19-9-6-7-11(15)12(16)8-9/h2-8H,1H3
InChIKey YFVNVFGDQAIOLM-UHFFFAOYSA-N
Molecular Weight 297.137 g/mol
SMILES C1=CC=C(C(=C1)OC)C(OC1=CC(=C(C=C1)Cl)Cl)=O