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Benzil, monoazine with 3,4,5-trimethoxybenzaldehyde
SpectraBase Compound ID LV9vfLpcWkO
InChI InChI=1S/C24H22N2O4/c1-28-20-14-17(15-21(29-2)24(20)30-3)16-25-26-22(18-10-6-4-7-11-18)23(27)19-12-8-5-9-13-19/h4-16H,1-3H3
InChIKey PGWBKJVMKSZZTR-UHFFFAOYSA-N
Mol Weight 402.45 g/mol
Molecular Formula C24H22N2O4
Exact Mass 402.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HQ1tG5ac6d
Name Benzil, monoazine with 3,4,5-trimethoxybenzaldehyde
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.157957192 u
Formula C24H22N2O4
InChI InChI=1S/C24H22N2O4/c1-28-20-14-17(15-21(29-2)24(20)30-3)16-25-26-22(18-10-6-4-7-11-18)23(27)19-12-8-5-9-13-19/h4-16H,1-3H3
InChIKey PGWBKJVMKSZZTR-UHFFFAOYSA-N
Molecular Weight 402.450 g/mol
SMILES C=1C(=CC=CC1)C(\C(C=1C=CC=CC1)=N\N=C\C=1C=C(C(=C(C1)OC)OC)OC)=O