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Bis(3-N-acetamidoquinazolin-4-one-2-yl)-m-phenylene
SpectraBase Compound ID 8ySo4KXsl7U
InChI InChI=1S/C26H20N6O4/c1-15(33)29-31-23(27-21-12-5-3-10-19(21)25(31)35)17-8-7-9-18(14-17)24-28-22-13-6-4-11-20(22)26(36)32(24)30-16(2)34/h3-14H,1-2H3,(H,29,33)(H,30,34)
InChIKey YDIKLFRBZIZMAL-UHFFFAOYSA-N
Mol Weight 480.48 g/mol
Molecular Formula C26H20N6O4
Exact Mass 480.154603 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GfUwZoghC9w
Name bis(3-N-Acetamidoquinazolin-4-one-2-yl)-m-phenylene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.154603144 u
Formula C26H20N6O4
InChI InChI=1S/C26H20N6O4/c1-15(33)29-31-23(27-21-12-5-3-10-19(21)25(31)35)17-8-7-9-18(14-17)24-28-22-13-6-4-11-20(22)26(36)32(24)30-16(2)34/h3-14H,1-2H3,(H,29,33)(H,30,34)
InChIKey YDIKLFRBZIZMAL-UHFFFAOYSA-N
Molecular Weight 480.484 g/mol
SMILES C=1(C=C(C=CC1)C1=NC=2C=CC=CC2C(N1NC(C)=O)=O)C1=NC=2C=CC=CC2C(N1NC(C)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866253