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Furo[2,3-D]pyrimidine-4,6(5H,7H)-dione, 2,3-dihydro-5-(4-chlorophenyl)-3-phenyl-
SpectraBase Compound ID 9UQ4oFeYsLJ
InChI InChI=1S/C20H17ClN2O3/c1-20(2)16(12-6-4-3-5-7-12)15-17(26-20)22-19(25)23(18(15)24)14-10-8-13(21)9-11-14/h3-11,16H,1-2H3,(H,22,25)
InChIKey OQVUXBHLICFHKU-UHFFFAOYSA-N
Mol Weight 368.82 g/mol
Molecular Formula C20H17ClN2O3
Exact Mass 368.09277 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KqaGWprpz6V
Name Furo[2,3-D]pyrimidine-4,6(5H,7H)-dione, 2,3-dihydro-5-(4-chlorophenyl)-3-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.092770112 u
Formula C20H17ClN2O3
InChI InChI=1S/C20H17ClN2O3/c1-20(2)16(12-6-4-3-5-7-12)15-17(26-20)22-19(25)23(18(15)24)14-10-8-13(21)9-11-14/h3-11,16H,1-2H3,(H,22,25)
InChIKey OQVUXBHLICFHKU-UHFFFAOYSA-N
Molecular Weight 368.820 g/mol
SMILES C1(Cl)=CC=C(N2C(=O)C3=C(NC2=O)OC(C)(C)C3C=2C=CC=CC2)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.922268