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Furo[2,3-D]pyrimidine-4,6(5H,7H)-dione,2,3-dihydro-5-(4-methoxyphenyl)-2,2-dimethyl-3-phenyl-
SpectraBase Compound ID EtQT47Gm5Iw
InChI InChI=1S/C21H20N2O4/c1-21(2)17(13-7-5-4-6-8-13)16-18(27-21)22-20(25)23(19(16)24)14-9-11-15(26-3)12-10-14/h4-12,17H,1-3H3,(H,22,25)
InChIKey CHBOXHTWAMNZGY-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A7woEjHSk8X
Name Furo[2,3-D]pyrimidine-4,6(5H,7H)-dione,2,3-dihydro-5-(4-methoxyphenyl)-2,2-dimethyl-3-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.142307128 u
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c1-21(2)17(13-7-5-4-6-8-13)16-18(27-21)22-20(25)23(19(16)24)14-9-11-15(26-3)12-10-14/h4-12,17H,1-3H3,(H,22,25)
InChIKey CHBOXHTWAMNZGY-UHFFFAOYSA-N
Molecular Weight 364.401 g/mol
SMILES COC1=CC=C(N2C(=O)C3=C(NC2=O)OC(C)(C)C3C=2C=CC=CC2)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923074