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1,3-Dibutyryl-5-[3,4-dimethoxybenzal]hydantoin
SpectraBase Compound ID B1xrY4K5R7O
InChI InChI=1S/C20H24N2O6/c1-5-7-17(23)21-14(19(25)22(20(21)26)18(24)8-6-2)11-13-9-10-15(27-3)16(12-13)28-4/h9-12H,5-8H2,1-4H3/b14-11+
InChIKey ZGUIYAPXRUCNTK-SDNWHVSQSA-N
Mol Weight 388.42 g/mol
Molecular Formula C20H24N2O6
Exact Mass 388.163436 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID X8OI1T0LYo
Name 1,3-Dibutyryl-5-[3,4-dimethoxybenzal]hydantoin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.163436495 u
Formula C20H24N2O6
InChI InChI=1S/C20H24N2O6/c1-5-7-17(23)21-14(19(25)22(20(21)26)18(24)8-6-2)11-13-9-10-15(27-3)16(12-13)28-4/h9-12H,5-8H2,1-4H3/b14-11+
InChIKey ZGUIYAPXRUCNTK-SDNWHVSQSA-N
Molecular Weight 388.420 g/mol
SMILES C1=C(C=CC(=C1OC)OC)\C=C/1C(=O)N(C(N1C(=O)CCC)=O)C(CCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.869216