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Fumaric acid, 2,4-dichlorophenyl naphth-2-ylmethyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 2,4-dichlorophenyl naphth-2-ylmethyl ester
SpectraBase Compound ID 6161P8acJtF
InChI InChI=1S/C21H14Cl2O4/c22-17-7-8-19(18(23)12-17)27-21(25)10-9-20(24)26-13-14-5-6-15-3-1-2-4-16(15)11-14/h1-12H,13H2/b10-9+
InChIKey RYVXWIBEEIYSNF-MDZDMXLPSA-N
Mol Weight 401.25 g/mol
Molecular Formula C21H14Cl2O4
Exact Mass 400.026914 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Btvu0UE8aQd
Name Fumaric acid, 2,4-dichlorophenyl naphth-2-ylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 400.026914327 u
Formula C21H14Cl2O4
InChI InChI=1S/C21H14Cl2O4/c22-17-7-8-19(18(23)12-17)27-21(25)10-9-20(24)26-13-14-5-6-15-3-1-2-4-16(15)11-14/h1-12H,13H2/b10-9+
InChIKey RYVXWIBEEIYSNF-MDZDMXLPSA-N
Molecular Weight 401.245 g/mol
SMILES C(\C=C\C(OCC1=CC2=C(C=CC=C2)C=C1)=O)(OC1=C(C=C(C=C1)Cl)Cl)=O