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3,3,6,6-Tetramethyl-1,8-dioxo-9-phenyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine
SpectraBase Compound ID 13IXv9DhXpT
InChI InChI=1S/C23H27NO2/c1-22(2)10-15-20(17(25)12-22)19(14-8-6-5-7-9-14)21-16(24-15)11-23(3,4)13-18(21)26/h5-9,19,24H,10-13H2,1-4H3
InChIKey KFTOHVZIRTYJBU-UHFFFAOYSA-N
Mol Weight 349.47 g/mol
Molecular Formula C23H27NO2
Exact Mass 349.204179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Bis7OhsYakL
Name 3,3,6,6-Tetramethyl-1,8-dioxo-9-phenyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.204179111 u
Formula C23H27NO2
InChI InChI=1S/C23H27NO2/c1-22(2)10-15-20(17(25)12-22)19(14-8-6-5-7-9-14)21-16(24-15)11-23(3,4)13-18(21)26/h5-9,19,24H,10-13H2,1-4H3
InChIKey KFTOHVZIRTYJBU-UHFFFAOYSA-N
Molecular Weight 349.474 g/mol
SMILES C1(=O)CC(C)(C)CC=2NC=3CC(C)(C)CC(=O)C3C(C12)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951544