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Fumaric acid, naphth-2-yl naphth-2-ylmethyl ester
SpectraBase Compound ID I4iyenaSnQT
InChI InChI=1S/C25H18O4/c26-24(28-17-18-9-10-19-5-1-3-7-21(19)15-18)13-14-25(27)29-23-12-11-20-6-2-4-8-22(20)16-23/h1-16H,17H2/b14-13+
InChIKey VMJFICAIDQTWSE-BUHFOSPRSA-N
Mol Weight 382.42 g/mol
Molecular Formula C25H18O4
Exact Mass 382.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JS9nr8eh1JC
Name Fumaric acid, naphth-2-yl naphth-2-ylmethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.120509056 u
Formula C25H18O4
InChI InChI=1S/C25H18O4/c26-24(28-17-18-9-10-19-5-1-3-7-21(19)15-18)13-14-25(27)29-23-12-11-20-6-2-4-8-22(20)16-23/h1-16H,17H2/b14-13+
InChIKey VMJFICAIDQTWSE-BUHFOSPRSA-N
Molecular Weight 382.415 g/mol
SMILES C(\C=C\C(OCC1=CC2=C(C=CC=C2)C=C1)=O)(OC1=CC=C2C(=C1)C=CC=C2)=O