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2,4(1H,3H)-Pyrimidinedione, 1,3-dicyclohexyl-5,6-diphenyl-
SpectraBase Compound ID 72VFyliTu28
InChI InChI=1S/C28H32N2O2/c31-27-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)29(23-17-9-3-10-18-23)28(32)30(27)24-19-11-4-12-20-24/h1-2,5-8,13-16,23-24H,3-4,9-12,17-20H2
InChIKey TUHIIANJGVPKNW-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C28H32N2O2
Exact Mass 428.246378 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ey5THLmEgwf
Name 2,4(1H,3H)-Pyrimidinedione, 1,3-dicyclohexyl-5,6-diphenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.246378276 u
Formula C28H32N2O2
InChI InChI=1S/C28H32N2O2/c31-27-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)29(23-17-9-3-10-18-23)28(32)30(27)24-19-11-4-12-20-24/h1-2,5-8,13-16,23-24H,3-4,9-12,17-20H2
InChIKey TUHIIANJGVPKNW-UHFFFAOYSA-N
Molecular Weight 428.576 g/mol
SMILES C1CCC(CC1)N1C(=O)N(C2CCCCC2)C(C(=C1C=1C=CC=CC1)C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877131